Sample Name	Protocol REF	Parameter Value[Post Extraction]	Parameter Value[Derivatization]	Extract Name	Protocol REF	Parameter Value[Chromatography Instrument]	Term Source REF	Term Accession Number	Parameter Value[Column model]	Parameter Value[Column type]	Labeled Extract Name	Label	Term Source REF	Term Accession Number	Protocol REF	Parameter Value[Scan polarity]	Parameter Value[Scan m/z range]	Parameter Value[Instrument]	Term Source REF	Term Accession Number	Parameter Value[Ion source]	Term Source REF	Term Accession Number	Parameter Value[Mass analyzer]	Term Source REF	Term Accession Number	MS Assay Name	Raw Spectral Data File	Protocol REF	Normalization Name	Derived Spectral Data File	Protocol REF	Data Transformation Name	Metabolite Assignment File	Factor Value[Batch run order]	Term Source REF	Term Accession Number	Factor Value[Run order]	Term Source REF	Term Accession Number
nist	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_002	FILES/RAW_FILES/C18_neg/VT_150411_002.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			2		
nist	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_004	FILES/RAW_FILES/C18_neg/VT_150411_004.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			4		
nist	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_006	FILES/RAW_FILES/C18_neg/VT_150411_006.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			6		
q3June2014a	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_008	FILES/RAW_FILES/C18_neg/VT_150411_008.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			8		
q3June2014a	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_010	FILES/RAW_FILES/C18_neg/VT_150411_010.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			10		
q3June2014a	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_012	FILES/RAW_FILES/C18_neg/VT_150411_012.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			12		
2416440	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_014	FILES/RAW_FILES/C18_neg/VT_150411_014.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			14		
2416440	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_016	FILES/RAW_FILES/C18_neg/VT_150411_016.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			16		
2416440	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_018	FILES/RAW_FILES/C18_neg/VT_150411_018.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			18		
2416441	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_020	FILES/RAW_FILES/C18_neg/VT_150411_020.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			20		
2416441	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_022	FILES/RAW_FILES/C18_neg/VT_150411_022.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			22		
2416441	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_024	FILES/RAW_FILES/C18_neg/VT_150411_024.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			24		
2416442	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_026	FILES/RAW_FILES/C18_neg/VT_150411_026.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			26		
2416442	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_028	FILES/RAW_FILES/C18_neg/VT_150411_028.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			28		
2416442	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_030	FILES/RAW_FILES/C18_neg/VT_150411_030.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			30		
2416443	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_032	FILES/RAW_FILES/C18_neg/VT_150411_032.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			32		
2416443	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_034	FILES/RAW_FILES/C18_neg/VT_150411_034.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			34		
2416443	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_036	FILES/RAW_FILES/C18_neg/VT_150411_036.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			36		
2416444	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_038	FILES/RAW_FILES/C18_neg/VT_150411_038.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			38		
2416444	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_040	FILES/RAW_FILES/C18_neg/VT_150411_040.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			40		
2416444	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_042	FILES/RAW_FILES/C18_neg/VT_150411_042.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			42		
2416405	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_044	FILES/RAW_FILES/C18_neg/VT_150411_044.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			44		
2416405	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_046	FILES/RAW_FILES/C18_neg/VT_150411_046.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			46		
2416405	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_048	FILES/RAW_FILES/C18_neg/VT_150411_048.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			48		
2416406	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_050	FILES/RAW_FILES/C18_neg/VT_150411_050.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			50		
2416406	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_052	FILES/RAW_FILES/C18_neg/VT_150411_052.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			52		
2416406	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_054	FILES/RAW_FILES/C18_neg/VT_150411_054.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			54		
2416407	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_056	FILES/RAW_FILES/C18_neg/VT_150411_056.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			56		
2416407	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_058	FILES/RAW_FILES/C18_neg/VT_150411_058.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			58		
2416407	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_060	FILES/RAW_FILES/C18_neg/VT_150411_060.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			60		
2416408	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_062	FILES/RAW_FILES/C18_neg/VT_150411_062.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			62		
2416408	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_064	FILES/RAW_FILES/C18_neg/VT_150411_064.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			64		
2416408	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_066	FILES/RAW_FILES/C18_neg/VT_150411_066.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			66		
2416409	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_068	FILES/RAW_FILES/C18_neg/VT_150411_068.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			68		
2416409	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_070	FILES/RAW_FILES/C18_neg/VT_150411_070.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			70		
2416409	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_072	FILES/RAW_FILES/C18_neg/VT_150411_072.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			72		
2416540	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_074	FILES/RAW_FILES/C18_neg/VT_150411_074.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			74		
2416540	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_076	FILES/RAW_FILES/C18_neg/VT_150411_076.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			76		
2416540	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_078	FILES/RAW_FILES/C18_neg/VT_150411_078.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			78		
2416541	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_080	FILES/RAW_FILES/C18_neg/VT_150411_080.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			80		
2416541	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_082	FILES/RAW_FILES/C18_neg/VT_150411_082.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			82		
2416541	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_084	FILES/RAW_FILES/C18_neg/VT_150411_084.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			84		
2416542	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_086	FILES/RAW_FILES/C18_neg/VT_150411_086.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			86		
2416542	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_088	FILES/RAW_FILES/C18_neg/VT_150411_088.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			88		
2416542	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_090	FILES/RAW_FILES/C18_neg/VT_150411_090.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			90		
2416543	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_092	FILES/RAW_FILES/C18_neg/VT_150411_092.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			92		
2416543	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_094	FILES/RAW_FILES/C18_neg/VT_150411_094.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			94		
2416543	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_096	FILES/RAW_FILES/C18_neg/VT_150411_096.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			96		
2416544	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_098	FILES/RAW_FILES/C18_neg/VT_150411_098.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			98		
2416544	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_100	FILES/RAW_FILES/C18_neg/VT_150411_100.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			100		
2416544	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_102	FILES/RAW_FILES/C18_neg/VT_150411_102.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			102		
2416480	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_104	FILES/RAW_FILES/C18_neg/VT_150411_104.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			104		
2416480	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_106	FILES/RAW_FILES/C18_neg/VT_150411_106.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			106		
2416480	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_108	FILES/RAW_FILES/C18_neg/VT_150411_108.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			108		
2416481	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_110	FILES/RAW_FILES/C18_neg/VT_150411_110.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			110		
2416481	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_112	FILES/RAW_FILES/C18_neg/VT_150411_112.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			112		
2416481	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_114	FILES/RAW_FILES/C18_neg/VT_150411_114.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			114		
2416482	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_116	FILES/RAW_FILES/C18_neg/VT_150411_116.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			116		
2416482	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_118	FILES/RAW_FILES/C18_neg/VT_150411_118.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			118		
2416482	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_120	FILES/RAW_FILES/C18_neg/VT_150411_120.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			120		
2416483	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_122	FILES/RAW_FILES/C18_neg/VT_150411_122.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			122		
2416483	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_124	FILES/RAW_FILES/C18_neg/VT_150411_124.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			124		
2416483	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_126	FILES/RAW_FILES/C18_neg/VT_150411_126.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			126		
2416484	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_128	FILES/RAW_FILES/C18_neg/VT_150411_128.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			128		
2416484	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_130	FILES/RAW_FILES/C18_neg/VT_150411_130.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			130		
2416484	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_132	FILES/RAW_FILES/C18_neg/VT_150411_132.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			132		
q3June2014b	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_134	FILES/RAW_FILES/C18_neg/VT_150411_134.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			134		
q3June2014b	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_136	FILES/RAW_FILES/C18_neg/VT_150411_136.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			136		
q3June2014b	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_138	FILES/RAW_FILES/C18_neg/VT_150411_138.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			138		
2416520	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_140	FILES/RAW_FILES/C18_neg/VT_150411_140.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			140		
2416520	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_142	FILES/RAW_FILES/C18_neg/VT_150411_142.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			142		
2416520	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_144	FILES/RAW_FILES/C18_neg/VT_150411_144.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			144		
2416521	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_146	FILES/RAW_FILES/C18_neg/VT_150411_146.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			146		
2416521	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_148	FILES/RAW_FILES/C18_neg/VT_150411_148.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			148		
2416521	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_150	FILES/RAW_FILES/C18_neg/VT_150411_150.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			150		
2416522	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_152	FILES/RAW_FILES/C18_neg/VT_150411_152.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			152		
2416522	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_154	FILES/RAW_FILES/C18_neg/VT_150411_154.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			154		
2416522	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_156	FILES/RAW_FILES/C18_neg/VT_150411_156.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			156		
2416523	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_158	FILES/RAW_FILES/C18_neg/VT_150411_158.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			158		
2416523	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_160	FILES/RAW_FILES/C18_neg/VT_150411_160.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			160		
2416523	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_162	FILES/RAW_FILES/C18_neg/VT_150411_162.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			162		
2416524	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_164	FILES/RAW_FILES/C18_neg/VT_150411_164.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			164		
2416524	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_166	FILES/RAW_FILES/C18_neg/VT_150411_166.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			166		
2416524	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_168	FILES/RAW_FILES/C18_neg/VT_150411_168.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			168		
2416445	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_170	FILES/RAW_FILES/C18_neg/VT_150411_170.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			170		
2416445	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_172	FILES/RAW_FILES/C18_neg/VT_150411_172.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			172		
2416445	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_174	FILES/RAW_FILES/C18_neg/VT_150411_174.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			174		
2416446	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_176	FILES/RAW_FILES/C18_neg/VT_150411_176.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			176		
2416446	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_178	FILES/RAW_FILES/C18_neg/VT_150411_178.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			178		
2416446	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_180	FILES/RAW_FILES/C18_neg/VT_150411_180.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			180		
2416447	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_182	FILES/RAW_FILES/C18_neg/VT_150411_182.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			182		
2416447	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_184	FILES/RAW_FILES/C18_neg/VT_150411_184.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			184		
2416447	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_186	FILES/RAW_FILES/C18_neg/VT_150411_186.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			186		
2416448	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_188	FILES/RAW_FILES/C18_neg/VT_150411_188.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			188		
2416448	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_190	FILES/RAW_FILES/C18_neg/VT_150411_190.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			190		
2416448	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_192	FILES/RAW_FILES/C18_neg/VT_150411_192.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			192		
2416449	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_194	FILES/RAW_FILES/C18_neg/VT_150411_194.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			194		
2416449	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_196	FILES/RAW_FILES/C18_neg/VT_150411_196.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			196		
2416449	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_198	FILES/RAW_FILES/C18_neg/VT_150411_198.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			198		
2416400	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_200	FILES/RAW_FILES/C18_neg/VT_150411_200.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			200		
2416400	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_202	FILES/RAW_FILES/C18_neg/VT_150411_202.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			202		
2416400	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_204	FILES/RAW_FILES/C18_neg/VT_150411_204.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			204		
2416401	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_206	FILES/RAW_FILES/C18_neg/VT_150411_206.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			206		
2416401	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_208	FILES/RAW_FILES/C18_neg/VT_150411_208.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			208		
2416401	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_210	FILES/RAW_FILES/C18_neg/VT_150411_210.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			210		
2416402	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_212	FILES/RAW_FILES/C18_neg/VT_150411_212.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			212		
2416402	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_214	FILES/RAW_FILES/C18_neg/VT_150411_214.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			214		
2416402	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_216	FILES/RAW_FILES/C18_neg/VT_150411_216.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			216		
2416403	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_218	FILES/RAW_FILES/C18_neg/VT_150411_218.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			218		
2416403	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_220	FILES/RAW_FILES/C18_neg/VT_150411_220.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			220		
2416403	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_222	FILES/RAW_FILES/C18_neg/VT_150411_222.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			222		
2416404	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_224	FILES/RAW_FILES/C18_neg/VT_150411_224.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			224		
2416404	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_226	FILES/RAW_FILES/C18_neg/VT_150411_226.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			226		
2416404	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_228	FILES/RAW_FILES/C18_neg/VT_150411_228.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			228		
2416545	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_230	FILES/RAW_FILES/C18_neg/VT_150411_230.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			230		
2416545	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_232	FILES/RAW_FILES/C18_neg/VT_150411_232.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			232		
2416545	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_234	FILES/RAW_FILES/C18_neg/VT_150411_234.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			234		
2416546	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_236	FILES/RAW_FILES/C18_neg/VT_150411_236.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			236		
2416546	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_238	FILES/RAW_FILES/C18_neg/VT_150411_238.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			238		
2416546	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_240	FILES/RAW_FILES/C18_neg/VT_150411_240.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			240		
2416547	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_242	FILES/RAW_FILES/C18_neg/VT_150411_242.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			242		
2416547	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_244	FILES/RAW_FILES/C18_neg/VT_150411_244.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			244		
2416547	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_246	FILES/RAW_FILES/C18_neg/VT_150411_246.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			246		
2416548	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_248	FILES/RAW_FILES/C18_neg/VT_150411_248.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			248		
2416548	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_250	FILES/RAW_FILES/C18_neg/VT_150411_250.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			250		
2416548	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_252	FILES/RAW_FILES/C18_neg/VT_150411_252.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			252		
2416549	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_254	FILES/RAW_FILES/C18_neg/VT_150411_254.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			254		
2416549	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_256	FILES/RAW_FILES/C18_neg/VT_150411_256.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			256		
2416549	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150411_258	FILES/RAW_FILES/C18_neg/VT_150411_258.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	1			258		
q3June2014c	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_002	FILES/RAW_FILES/C18_neg/VT_150412_002.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			260		
q3June2014c	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_004	FILES/RAW_FILES/C18_neg/VT_150412_004.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			262		
q3June2014c	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_006	FILES/RAW_FILES/C18_neg/VT_150412_006.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			264		
2416485	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_008	FILES/RAW_FILES/C18_neg/VT_150412_008.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			266		
2416485	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_010	FILES/RAW_FILES/C18_neg/VT_150412_010.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			268		
2416485	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_012	FILES/RAW_FILES/C18_neg/VT_150412_012.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			270		
2416486	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_014	FILES/RAW_FILES/C18_neg/VT_150412_014.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			272		
2416486	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_016	FILES/RAW_FILES/C18_neg/VT_150412_016.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			274		
2416486	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_018	FILES/RAW_FILES/C18_neg/VT_150412_018.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			276		
2416487	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_020	FILES/RAW_FILES/C18_neg/VT_150412_020.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			278		
2416487	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_022	FILES/RAW_FILES/C18_neg/VT_150412_022.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			280		
2416487	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_024	FILES/RAW_FILES/C18_neg/VT_150412_024.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			282		
2416488	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_026	FILES/RAW_FILES/C18_neg/VT_150412_026.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			284		
2416488	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_028	FILES/RAW_FILES/C18_neg/VT_150412_028.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			286		
2416488	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_030	FILES/RAW_FILES/C18_neg/VT_150412_030.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			288		
2416489	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_032	FILES/RAW_FILES/C18_neg/VT_150412_032.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			290		
2416489	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_034	FILES/RAW_FILES/C18_neg/VT_150412_034.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			292		
2416489	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_036	FILES/RAW_FILES/C18_neg/VT_150412_036.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			294		
2416525	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_038	FILES/RAW_FILES/C18_neg/VT_150412_038.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			296		
2416525	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_040	FILES/RAW_FILES/C18_neg/VT_150412_040.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			298		
2416525	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_042	FILES/RAW_FILES/C18_neg/VT_150412_042.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			300		
2416526	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_044	FILES/RAW_FILES/C18_neg/VT_150412_044.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			302		
2416526	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_046	FILES/RAW_FILES/C18_neg/VT_150412_046.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			304		
2416526	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_048	FILES/RAW_FILES/C18_neg/VT_150412_048.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			306		
2416527	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_050	FILES/RAW_FILES/C18_neg/VT_150412_050.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			308		
2416527	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_052	FILES/RAW_FILES/C18_neg/VT_150412_052.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			310		
2416527	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_054	FILES/RAW_FILES/C18_neg/VT_150412_054.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			312		
2416528	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_056	FILES/RAW_FILES/C18_neg/VT_150412_056.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			314		
2416528	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_058	FILES/RAW_FILES/C18_neg/VT_150412_058.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			316		
2416528	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_060	FILES/RAW_FILES/C18_neg/VT_150412_060.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			318		
2416529	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_062	FILES/RAW_FILES/C18_neg/VT_150412_062.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			320		
2416529	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_064	FILES/RAW_FILES/C18_neg/VT_150412_064.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			322		
2416529	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_066	FILES/RAW_FILES/C18_neg/VT_150412_066.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			324		
2416450	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_068	FILES/RAW_FILES/C18_neg/VT_150412_068.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			326		
2416450	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_070	FILES/RAW_FILES/C18_neg/VT_150412_070.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			328		
2416450	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_072	FILES/RAW_FILES/C18_neg/VT_150412_072.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			330		
2416451	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_074	FILES/RAW_FILES/C18_neg/VT_150412_074.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			332		
2416451	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_076	FILES/RAW_FILES/C18_neg/VT_150412_076.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			334		
2416451	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_078	FILES/RAW_FILES/C18_neg/VT_150412_078.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			336		
2416452	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_080	FILES/RAW_FILES/C18_neg/VT_150412_080.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			338		
2416452	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_082	FILES/RAW_FILES/C18_neg/VT_150412_082.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			340		
2416452	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_084	FILES/RAW_FILES/C18_neg/VT_150412_084.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			342		
2416453	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_086	FILES/RAW_FILES/C18_neg/VT_150412_086.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			344		
2416453	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_088	FILES/RAW_FILES/C18_neg/VT_150412_088.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			346		
2416453	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_090	FILES/RAW_FILES/C18_neg/VT_150412_090.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			348		
2416454	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_092	FILES/RAW_FILES/C18_neg/VT_150412_092.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			350		
2416454	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_094	FILES/RAW_FILES/C18_neg/VT_150412_094.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			352		
2416454	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_096	FILES/RAW_FILES/C18_neg/VT_150412_096.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			354		
2416395	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_098	FILES/RAW_FILES/C18_neg/VT_150412_098.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			356		
2416395	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_100	FILES/RAW_FILES/C18_neg/VT_150412_100.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			358		
2416395	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_102	FILES/RAW_FILES/C18_neg/VT_150412_102.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			360		
2416396	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_104	FILES/RAW_FILES/C18_neg/VT_150412_104.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			362		
2416396	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_106	FILES/RAW_FILES/C18_neg/VT_150412_106.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			364		
2416396	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_108	FILES/RAW_FILES/C18_neg/VT_150412_108.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			366		
2416397	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_110	FILES/RAW_FILES/C18_neg/VT_150412_110.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			368		
2416397	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_112	FILES/RAW_FILES/C18_neg/VT_150412_112.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			370		
2416397	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_114	FILES/RAW_FILES/C18_neg/VT_150412_114.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			372		
2416398	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_116	FILES/RAW_FILES/C18_neg/VT_150412_116.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			374		
2416398	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_118	FILES/RAW_FILES/C18_neg/VT_150412_118.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			376		
2416398	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_120	FILES/RAW_FILES/C18_neg/VT_150412_120.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			378		
2416399	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_122	FILES/RAW_FILES/C18_neg/VT_150412_122.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			380		
2416399	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_124	FILES/RAW_FILES/C18_neg/VT_150412_124.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			382		
2416399	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_126	FILES/RAW_FILES/C18_neg/VT_150412_126.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			384		
q3June2014d	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_128	FILES/RAW_FILES/C18_neg/VT_150412_128.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			386		
q3June2014d	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_130	FILES/RAW_FILES/C18_neg/VT_150412_130.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			388		
q3June2014d	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_132	FILES/RAW_FILES/C18_neg/VT_150412_132.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			390		
2416550	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_134	FILES/RAW_FILES/C18_neg/VT_150412_134.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			392		
2416550	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_136	FILES/RAW_FILES/C18_neg/VT_150412_136.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			394		
2416550	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_138	FILES/RAW_FILES/C18_neg/VT_150412_138.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			396		
2416551	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_140	FILES/RAW_FILES/C18_neg/VT_150412_140.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			398		
2416551	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_142	FILES/RAW_FILES/C18_neg/VT_150412_142.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			400		
2416551	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_144	FILES/RAW_FILES/C18_neg/VT_150412_144.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			402		
2416552	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_146	FILES/RAW_FILES/C18_neg/VT_150412_146.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			404		
2416552	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_148	FILES/RAW_FILES/C18_neg/VT_150412_148.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			406		
2416552	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_150	FILES/RAW_FILES/C18_neg/VT_150412_150.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			408		
2416553	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_152	FILES/RAW_FILES/C18_neg/VT_150412_152.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			410		
2416553	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_154	FILES/RAW_FILES/C18_neg/VT_150412_154.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			412		
2416553	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_156	FILES/RAW_FILES/C18_neg/VT_150412_156.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			414		
2416554	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_158	FILES/RAW_FILES/C18_neg/VT_150412_158.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			416		
2416554	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_160	FILES/RAW_FILES/C18_neg/VT_150412_160.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			418		
2416554	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_162	FILES/RAW_FILES/C18_neg/VT_150412_162.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			420		
2416490	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_164	FILES/RAW_FILES/C18_neg/VT_150412_164.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			422		
2416490	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_166	FILES/RAW_FILES/C18_neg/VT_150412_166.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			424		
2416490	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_168	FILES/RAW_FILES/C18_neg/VT_150412_168.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			426		
2416491	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_170	FILES/RAW_FILES/C18_neg/VT_150412_170.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			428		
2416491	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_172	FILES/RAW_FILES/C18_neg/VT_150412_172.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			430		
2416491	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_174	FILES/RAW_FILES/C18_neg/VT_150412_174.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			432		
2416492	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_176	FILES/RAW_FILES/C18_neg/VT_150412_176.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			434		
2416492	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_178	FILES/RAW_FILES/C18_neg/VT_150412_178.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			436		
2416492	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_180	FILES/RAW_FILES/C18_neg/VT_150412_180.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			438		
2416493	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_182	FILES/RAW_FILES/C18_neg/VT_150412_182.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			440		
2416493	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_184	FILES/RAW_FILES/C18_neg/VT_150412_184.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			442		
2416493	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_186	FILES/RAW_FILES/C18_neg/VT_150412_186.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			444		
2416494	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_188	FILES/RAW_FILES/C18_neg/VT_150412_188.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			446		
2416494	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_190	FILES/RAW_FILES/C18_neg/VT_150412_190.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			448		
2416494	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_192	FILES/RAW_FILES/C18_neg/VT_150412_192.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			450		
2416500	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_194	FILES/RAW_FILES/C18_neg/VT_150412_194.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			452		
2416500	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_196	FILES/RAW_FILES/C18_neg/VT_150412_196.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			454		
2416500	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_198	FILES/RAW_FILES/C18_neg/VT_150412_198.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			456		
2416501	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_200	FILES/RAW_FILES/C18_neg/VT_150412_200.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			458		
2416501	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_202	FILES/RAW_FILES/C18_neg/VT_150412_202.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			460		
2416501	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_204	FILES/RAW_FILES/C18_neg/VT_150412_204.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			462		
2416502	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_206	FILES/RAW_FILES/C18_neg/VT_150412_206.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			464		
2416502	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_208	FILES/RAW_FILES/C18_neg/VT_150412_208.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			466		
2416502	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_210	FILES/RAW_FILES/C18_neg/VT_150412_210.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			468		
2416503	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_212	FILES/RAW_FILES/C18_neg/VT_150412_212.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			470		
2416503	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_214	FILES/RAW_FILES/C18_neg/VT_150412_214.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			472		
2416503	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_216	FILES/RAW_FILES/C18_neg/VT_150412_216.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			474		
2416504	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_218	FILES/RAW_FILES/C18_neg/VT_150412_218.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			476		
2416504	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_220	FILES/RAW_FILES/C18_neg/VT_150412_220.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			478		
2416504	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_222	FILES/RAW_FILES/C18_neg/VT_150412_222.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			480		
2416455	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_224	FILES/RAW_FILES/C18_neg/VT_150412_224.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			482		
2416455	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_226	FILES/RAW_FILES/C18_neg/VT_150412_226.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			484		
2416455	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_228	FILES/RAW_FILES/C18_neg/VT_150412_228.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			486		
2416456	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_230	FILES/RAW_FILES/C18_neg/VT_150412_230.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			488		
2416456	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_232	FILES/RAW_FILES/C18_neg/VT_150412_232.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			490		
2416456	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_234	FILES/RAW_FILES/C18_neg/VT_150412_234.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			492		
2416457	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_236	FILES/RAW_FILES/C18_neg/VT_150412_236.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			494		
2416457	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_238	FILES/RAW_FILES/C18_neg/VT_150412_238.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			496		
2416457	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_240	FILES/RAW_FILES/C18_neg/VT_150412_240.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			498		
2416458	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_242	FILES/RAW_FILES/C18_neg/VT_150412_242.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			500		
2416458	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_244	FILES/RAW_FILES/C18_neg/VT_150412_244.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			502		
2416458	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_246	FILES/RAW_FILES/C18_neg/VT_150412_246.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			504		
2416459	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_248	FILES/RAW_FILES/C18_neg/VT_150412_248.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			506		
2416459	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_250	FILES/RAW_FILES/C18_neg/VT_150412_250.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			508		
2416459	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_252	FILES/RAW_FILES/C18_neg/VT_150412_252.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			510		
q3June2014e	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_254	FILES/RAW_FILES/C18_neg/VT_150412_254.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			512		
q3June2014e	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_256	FILES/RAW_FILES/C18_neg/VT_150412_256.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			514		
q3June2014e	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150412_258	FILES/RAW_FILES/C18_neg/VT_150412_258.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	2			516		
q3June2014f	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_002	FILES/RAW_FILES/C18_neg/VT_150413_002.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			518		
q3June2014f	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_004	FILES/RAW_FILES/C18_neg/VT_150413_004.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			520		
q3June2014f	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_006	FILES/RAW_FILES/C18_neg/VT_150413_006.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			522		
2416214	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_008	FILES/RAW_FILES/C18_neg/VT_150413_008.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			524		
2416214	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_010	FILES/RAW_FILES/C18_neg/VT_150413_010.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			526		
2416214	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_012	FILES/RAW_FILES/C18_neg/VT_150413_012.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			528		
2416215	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_014	FILES/RAW_FILES/C18_neg/VT_150413_014.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			530		
2416215	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_016	FILES/RAW_FILES/C18_neg/VT_150413_016.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			532		
2416215	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_018	FILES/RAW_FILES/C18_neg/VT_150413_018.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			534		
2416296	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_020	FILES/RAW_FILES/C18_neg/VT_150413_020.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			536		
2416296	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_022	FILES/RAW_FILES/C18_neg/VT_150413_022.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			538		
2416296	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_024	FILES/RAW_FILES/C18_neg/VT_150413_024.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			540		
2416393	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_026	FILES/RAW_FILES/C18_neg/VT_150413_026.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			542		
2416393	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_028	FILES/RAW_FILES/C18_neg/VT_150413_028.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			544		
2416393	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_030	FILES/RAW_FILES/C18_neg/VT_150413_030.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			546		
2416394	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_032	FILES/RAW_FILES/C18_neg/VT_150413_032.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			548		
2416394	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_034	FILES/RAW_FILES/C18_neg/VT_150413_034.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			550		
2416394	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_036	FILES/RAW_FILES/C18_neg/VT_150413_036.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			552		
2416535	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_038	FILES/RAW_FILES/C18_neg/VT_150413_038.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			554		
2416535	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_040	FILES/RAW_FILES/C18_neg/VT_150413_040.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			556		
2416535	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_042	FILES/RAW_FILES/C18_neg/VT_150413_042.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			558		
2416536	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_044	FILES/RAW_FILES/C18_neg/VT_150413_044.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			560		
2416536	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_046	FILES/RAW_FILES/C18_neg/VT_150413_046.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			562		
2416536	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_048	FILES/RAW_FILES/C18_neg/VT_150413_048.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			564		
2416537	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_050	FILES/RAW_FILES/C18_neg/VT_150413_050.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			566		
2416537	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_052	FILES/RAW_FILES/C18_neg/VT_150413_052.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			568		
2416537	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_054	FILES/RAW_FILES/C18_neg/VT_150413_054.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			570		
2416538	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_056	FILES/RAW_FILES/C18_neg/VT_150413_056.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			572		
2416538	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_058	FILES/RAW_FILES/C18_neg/VT_150413_058.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			574		
2416538	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_060	FILES/RAW_FILES/C18_neg/VT_150413_060.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			576		
2416539	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_062	FILES/RAW_FILES/C18_neg/VT_150413_062.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			578		
2416539	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_064	FILES/RAW_FILES/C18_neg/VT_150413_064.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			580		
2416539	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_066	FILES/RAW_FILES/C18_neg/VT_150413_066.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			582		
2416495	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_068	FILES/RAW_FILES/C18_neg/VT_150413_068.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			584		
2416495	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_070	FILES/RAW_FILES/C18_neg/VT_150413_070.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			586		
2416495	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_072	FILES/RAW_FILES/C18_neg/VT_150413_072.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			588		
2416496	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_074	FILES/RAW_FILES/C18_neg/VT_150413_074.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			590		
2416496	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_076	FILES/RAW_FILES/C18_neg/VT_150413_076.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			592		
2416496	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_078	FILES/RAW_FILES/C18_neg/VT_150413_078.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			594		
2416497	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_080	FILES/RAW_FILES/C18_neg/VT_150413_080.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			596		
2416497	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_082	FILES/RAW_FILES/C18_neg/VT_150413_082.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			598		
2416497	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_084	FILES/RAW_FILES/C18_neg/VT_150413_084.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			600		
2416498	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_086	FILES/RAW_FILES/C18_neg/VT_150413_086.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			602		
2416498	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_088	FILES/RAW_FILES/C18_neg/VT_150413_088.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			604		
2416498	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_090	FILES/RAW_FILES/C18_neg/VT_150413_090.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			606		
2416499	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_092	FILES/RAW_FILES/C18_neg/VT_150413_092.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			608		
2416499	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_094	FILES/RAW_FILES/C18_neg/VT_150413_094.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			610		
2416499	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_096	FILES/RAW_FILES/C18_neg/VT_150413_096.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			612		
2416505	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_098	FILES/RAW_FILES/C18_neg/VT_150413_098.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			614		
2416505	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_100	FILES/RAW_FILES/C18_neg/VT_150413_100.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			616		
2416505	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_102	FILES/RAW_FILES/C18_neg/VT_150413_102.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			618		
2416506	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_104	FILES/RAW_FILES/C18_neg/VT_150413_104.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			620		
2416506	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_106	FILES/RAW_FILES/C18_neg/VT_150413_106.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			622		
2416506	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_108	FILES/RAW_FILES/C18_neg/VT_150413_108.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			624		
2416507	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_110	FILES/RAW_FILES/C18_neg/VT_150413_110.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			626		
2416507	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_112	FILES/RAW_FILES/C18_neg/VT_150413_112.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			628		
2416507	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_114	FILES/RAW_FILES/C18_neg/VT_150413_114.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			630		
2416508	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_116	FILES/RAW_FILES/C18_neg/VT_150413_116.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			632		
2416508	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_118	FILES/RAW_FILES/C18_neg/VT_150413_118.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			634		
2416508	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_120	FILES/RAW_FILES/C18_neg/VT_150413_120.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			636		
2416509	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_122	FILES/RAW_FILES/C18_neg/VT_150413_122.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			638		
2416509	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_124	FILES/RAW_FILES/C18_neg/VT_150413_124.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			640		
2416509	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_126	FILES/RAW_FILES/C18_neg/VT_150413_126.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			642		
q3June2014g	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_128	FILES/RAW_FILES/C18_neg/VT_150413_128.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			644		
q3June2014g	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_130	FILES/RAW_FILES/C18_neg/VT_150413_130.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			646		
q3June2014g	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_132	FILES/RAW_FILES/C18_neg/VT_150413_132.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			648		
2416460	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_134	FILES/RAW_FILES/C18_neg/VT_150413_134.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			650		
2416460	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_136	FILES/RAW_FILES/C18_neg/VT_150413_136.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			652		
2416460	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_138	FILES/RAW_FILES/C18_neg/VT_150413_138.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			654		
2416461	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_140	FILES/RAW_FILES/C18_neg/VT_150413_140.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			656		
2416461	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_142	FILES/RAW_FILES/C18_neg/VT_150413_142.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			658		
2416461	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_144	FILES/RAW_FILES/C18_neg/VT_150413_144.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			660		
2416462	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_146	FILES/RAW_FILES/C18_neg/VT_150413_146.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			662		
2416462	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_148	FILES/RAW_FILES/C18_neg/VT_150413_148.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			664		
2416462	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_150	FILES/RAW_FILES/C18_neg/VT_150413_150.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			666		
2416463	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_152	FILES/RAW_FILES/C18_neg/VT_150413_152.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			668		
2416463	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_154	FILES/RAW_FILES/C18_neg/VT_150413_154.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			670		
2416463	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_156	FILES/RAW_FILES/C18_neg/VT_150413_156.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			672		
2416464	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_158	FILES/RAW_FILES/C18_neg/VT_150413_158.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			674		
2416464	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_160	FILES/RAW_FILES/C18_neg/VT_150413_160.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			676		
2416464	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_162	FILES/RAW_FILES/C18_neg/VT_150413_162.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			678		
2416470	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_164	FILES/RAW_FILES/C18_neg/VT_150413_164.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			680		
2416470	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_166	FILES/RAW_FILES/C18_neg/VT_150413_166.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			682		
2416470	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_168	FILES/RAW_FILES/C18_neg/VT_150413_168.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			684		
2416471	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_170	FILES/RAW_FILES/C18_neg/VT_150413_170.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			686		
2416471	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_172	FILES/RAW_FILES/C18_neg/VT_150413_172.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			688		
2416471	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_174	FILES/RAW_FILES/C18_neg/VT_150413_174.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			690		
2416472	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_176	FILES/RAW_FILES/C18_neg/VT_150413_176.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			692		
2416472	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_178	FILES/RAW_FILES/C18_neg/VT_150413_178.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			694		
2416472	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_180	FILES/RAW_FILES/C18_neg/VT_150413_180.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			696		
2416473	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_182	FILES/RAW_FILES/C18_neg/VT_150413_182.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			698		
2416473	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_184	FILES/RAW_FILES/C18_neg/VT_150413_184.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			700		
2416473	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_186	FILES/RAW_FILES/C18_neg/VT_150413_186.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			702		
2416474	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_188	FILES/RAW_FILES/C18_neg/VT_150413_188.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			704		
2416474	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_190	FILES/RAW_FILES/C18_neg/VT_150413_190.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			706		
2416474	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_192	FILES/RAW_FILES/C18_neg/VT_150413_192.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			708		
2416510	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_194	FILES/RAW_FILES/C18_neg/VT_150413_194.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			710		
2416510	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_196	FILES/RAW_FILES/C18_neg/VT_150413_196.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			712		
2416510	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_198	FILES/RAW_FILES/C18_neg/VT_150413_198.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			714		
2416511	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_200	FILES/RAW_FILES/C18_neg/VT_150413_200.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			716		
2416511	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_202	FILES/RAW_FILES/C18_neg/VT_150413_202.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			718		
2416511	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_204	FILES/RAW_FILES/C18_neg/VT_150413_204.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			720		
2416512	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_206	FILES/RAW_FILES/C18_neg/VT_150413_206.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			722		
2416512	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_208	FILES/RAW_FILES/C18_neg/VT_150413_208.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			724		
2416512	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_210	FILES/RAW_FILES/C18_neg/VT_150413_210.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			726		
2416513	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_212	FILES/RAW_FILES/C18_neg/VT_150413_212.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			728		
2416513	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_214	FILES/RAW_FILES/C18_neg/VT_150413_214.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			730		
2416513	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_216	FILES/RAW_FILES/C18_neg/VT_150413_216.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			732		
2416514	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_218	FILES/RAW_FILES/C18_neg/VT_150413_218.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			734		
2416514	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_220	FILES/RAW_FILES/C18_neg/VT_150413_220.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			736		
2416514	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_222	FILES/RAW_FILES/C18_neg/VT_150413_222.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			738		
2416209	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_224	FILES/RAW_FILES/C18_neg/VT_150413_224.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			740		
2416209	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_226	FILES/RAW_FILES/C18_neg/VT_150413_226.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			742		
2416209	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_228	FILES/RAW_FILES/C18_neg/VT_150413_228.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			744		
2416210	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_230	FILES/RAW_FILES/C18_neg/VT_150413_230.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			746		
2416210	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_232	FILES/RAW_FILES/C18_neg/VT_150413_232.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			748		
2416210	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_234	FILES/RAW_FILES/C18_neg/VT_150413_234.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			750		
2416211	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_236	FILES/RAW_FILES/C18_neg/VT_150413_236.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			752		
2416211	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_238	FILES/RAW_FILES/C18_neg/VT_150413_238.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			754		
2416211	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_240	FILES/RAW_FILES/C18_neg/VT_150413_240.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			756		
2416212	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_242	FILES/RAW_FILES/C18_neg/VT_150413_242.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			758		
2416212	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_244	FILES/RAW_FILES/C18_neg/VT_150413_244.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			760		
2416212	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_246	FILES/RAW_FILES/C18_neg/VT_150413_246.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			762		
2416213	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_248	FILES/RAW_FILES/C18_neg/VT_150413_248.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			764		
2416213	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_250	FILES/RAW_FILES/C18_neg/VT_150413_250.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			766		
2416213	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_252	FILES/RAW_FILES/C18_neg/VT_150413_252.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			768		
q3June2014h	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_254	FILES/RAW_FILES/C18_neg/VT_150413_254.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			770		
q3June2014h	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_256	FILES/RAW_FILES/C18_neg/VT_150413_256.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			772		
q3June2014h	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150413_258	FILES/RAW_FILES/C18_neg/VT_150413_258.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	3			774		
q3June2014i	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_002	FILES/RAW_FILES/C18_neg/VT_150414_002.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			776		
q3June2014i	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_004	FILES/RAW_FILES/C18_neg/VT_150414_004.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			778		
q3June2014i	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_006	FILES/RAW_FILES/C18_neg/VT_150414_006.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			780		
2416475	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_008	FILES/RAW_FILES/C18_neg/VT_150414_008.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			782		
2416475	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_010	FILES/RAW_FILES/C18_neg/VT_150414_010.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			784		
2416475	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_012	FILES/RAW_FILES/C18_neg/VT_150414_012.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			786		
2416476	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_014	FILES/RAW_FILES/C18_neg/VT_150414_014.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			788		
2416476	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_016	FILES/RAW_FILES/C18_neg/VT_150414_016.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			790		
2416476	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_018	FILES/RAW_FILES/C18_neg/VT_150414_018.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			792		
2416477	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_020	FILES/RAW_FILES/C18_neg/VT_150414_020.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			794		
2416477	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_022	FILES/RAW_FILES/C18_neg/VT_150414_022.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			796		
2416477	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_024	FILES/RAW_FILES/C18_neg/VT_150414_024.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			798		
2416478	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_026	FILES/RAW_FILES/C18_neg/VT_150414_026.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			800		
2416478	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_028	FILES/RAW_FILES/C18_neg/VT_150414_028.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			802		
2416478	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_030	FILES/RAW_FILES/C18_neg/VT_150414_030.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			804		
2416479	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_032	FILES/RAW_FILES/C18_neg/VT_150414_032.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			806		
2416479	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_034	FILES/RAW_FILES/C18_neg/VT_150414_034.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			808		
2416479	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_036	FILES/RAW_FILES/C18_neg/VT_150414_036.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			810		
2416465	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_038	FILES/RAW_FILES/C18_neg/VT_150414_038.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			812		
2416465	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_040	FILES/RAW_FILES/C18_neg/VT_150414_040.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			814		
2416465	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_042	FILES/RAW_FILES/C18_neg/VT_150414_042.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			816		
2416466	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_044	FILES/RAW_FILES/C18_neg/VT_150414_044.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			818		
2416466	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_046	FILES/RAW_FILES/C18_neg/VT_150414_046.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			820		
2416466	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_048	FILES/RAW_FILES/C18_neg/VT_150414_048.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			822		
2416467	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_050	FILES/RAW_FILES/C18_neg/VT_150414_050.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			824		
2416467	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_052	FILES/RAW_FILES/C18_neg/VT_150414_052.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			826		
2416467	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_054	FILES/RAW_FILES/C18_neg/VT_150414_054.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			828		
2416468	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_056	FILES/RAW_FILES/C18_neg/VT_150414_056.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			830		
2416468	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_058	FILES/RAW_FILES/C18_neg/VT_150414_058.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			832		
2416468	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_060	FILES/RAW_FILES/C18_neg/VT_150414_060.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			834		
2416469	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_062	FILES/RAW_FILES/C18_neg/VT_150414_062.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			836		
2416469	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_064	FILES/RAW_FILES/C18_neg/VT_150414_064.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			838		
2416469	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_066	FILES/RAW_FILES/C18_neg/VT_150414_066.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			840		
2416515	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_068	FILES/RAW_FILES/C18_neg/VT_150414_068.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			842		
2416515	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_070	FILES/RAW_FILES/C18_neg/VT_150414_070.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			844		
2416515	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_072	FILES/RAW_FILES/C18_neg/VT_150414_072.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			846		
2416516	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_074	FILES/RAW_FILES/C18_neg/VT_150414_074.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			848		
2416516	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_076	FILES/RAW_FILES/C18_neg/VT_150414_076.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			850		
2416516	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_078	FILES/RAW_FILES/C18_neg/VT_150414_078.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			852		
2416517	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_080	FILES/RAW_FILES/C18_neg/VT_150414_080.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			854		
2416517	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_082	FILES/RAW_FILES/C18_neg/VT_150414_082.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			856		
2416517	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_084	FILES/RAW_FILES/C18_neg/VT_150414_084.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			858		
2416518	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_086	FILES/RAW_FILES/C18_neg/VT_150414_086.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			860		
2416518	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_088	FILES/RAW_FILES/C18_neg/VT_150414_088.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			862		
2416518	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_090	FILES/RAW_FILES/C18_neg/VT_150414_090.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			864		
2416519	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_092	FILES/RAW_FILES/C18_neg/VT_150414_092.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			866		
2416519	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_094	FILES/RAW_FILES/C18_neg/VT_150414_094.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			868		
2416519	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_096	FILES/RAW_FILES/C18_neg/VT_150414_096.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			870		
2416176	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_098	FILES/RAW_FILES/C18_neg/VT_150414_098.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			872		
2416176	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_100	FILES/RAW_FILES/C18_neg/VT_150414_100.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			874		
2416176	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_102	FILES/RAW_FILES/C18_neg/VT_150414_102.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			876		
2416200	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_104	FILES/RAW_FILES/C18_neg/VT_150414_104.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			878		
2416200	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_106	FILES/RAW_FILES/C18_neg/VT_150414_106.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			880		
2416200	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_108	FILES/RAW_FILES/C18_neg/VT_150414_108.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			882		
2416201	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_110	FILES/RAW_FILES/C18_neg/VT_150414_110.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			884		
2416201	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_112	FILES/RAW_FILES/C18_neg/VT_150414_112.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			886		
2416201	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_114	FILES/RAW_FILES/C18_neg/VT_150414_114.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			888		
2416202	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_116	FILES/RAW_FILES/C18_neg/VT_150414_116.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			890		
2416202	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_118	FILES/RAW_FILES/C18_neg/VT_150414_118.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			892		
2416202	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_120	FILES/RAW_FILES/C18_neg/VT_150414_120.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			894		
2416203	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_122	FILES/RAW_FILES/C18_neg/VT_150414_122.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			896		
2416203	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_124	FILES/RAW_FILES/C18_neg/VT_150414_124.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			898		
2416203	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_126	FILES/RAW_FILES/C18_neg/VT_150414_126.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			900		
2416555	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_128	FILES/RAW_FILES/C18_neg/VT_150414_128.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			902		
2416555	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_130	FILES/RAW_FILES/C18_neg/VT_150414_130.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			904		
2416555	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_132	FILES/RAW_FILES/C18_neg/VT_150414_132.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			906		
2416556	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_134	FILES/RAW_FILES/C18_neg/VT_150414_134.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			908		
2416556	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_136	FILES/RAW_FILES/C18_neg/VT_150414_136.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			910		
2416556	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_138	FILES/RAW_FILES/C18_neg/VT_150414_138.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			912		
q3June2014j	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_140	FILES/RAW_FILES/C18_neg/VT_150414_140.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			914		
q3June2014j	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_142	FILES/RAW_FILES/C18_neg/VT_150414_142.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			916		
q3June2014j	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_144	FILES/RAW_FILES/C18_neg/VT_150414_144.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			918		
nist2	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_146	FILES/RAW_FILES/C18_neg/VT_150414_146.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			920		
nist2	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_148	FILES/RAW_FILES/C18_neg/VT_150414_148.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			922		
nist2	Extraction				Chromatography	Thermo Scientific Dionex Ultimate 3000 HPLC system			TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical)	reverse phase					Mass spectrometry	negative	85-1275	Thermo Scientific Q Exactive HF			electrospray ionization	MS	http://purl.obolibrary.org/obo/MS_1000073	orbitrap	MS		VT_150414_150	FILES/RAW_FILES/C18_neg/VT_150414_150.cdf	Data transformation			Metabolite identification		m_MTBLS664_hub_c18neg.tsv	4			924		
