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Analysis: GC UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
DimethylglycineDimethylglycineME558646----
EthanolamineEthanolamineME558647----
Pyruvic acidPyruvic acidME558648----
L-Lactic acidLactic acidME558649----
Alpha-Hydroxyisobutyric acid2-Hydroxyisobutyric acidME558650----
Glycolic acidGlycolic acidME558651----
Caproic acidCaproic acidME558652----
2-Ketobutyric acid3-Methyl pyruvic acidME558653----
Labelled compound_Alanine-ME558654----
Alpha-ketoisovaleric acidKetoisovaleric acidME558655----
GlycineGlycineME558656----
Oxalic acidOxalic acidME558657----
HydroxylamineHydroxylamineME558658----
2-Hydroxybutyric acid2-Hydroxybutyric acidME558659----
Acetoacetic acidAcetoacetic acidME558660----
Pyruvic acid2Pyruvic acidME558661----
3-Hydroxybutyric acid3-Hydroxybutyric acidME558662----
(S)-3-Hydroxyisobutyric acid3-Hydroxyisobutyric acidME558663----
2-Hydroxy-3-methylbutyric acid2-Hydroxy-3-methylbutyric acidME558664----
D-Alpha-aminobutyric acid2R-Aminobutyric acidME558665----
Beta-Alaninebeta-AlanineME558666----
3-Hydroxyisovaleric acid3-Hydroxyisovaleric acidME558667----
KetoleucineKetoleucineME558668----
L-ValineValineME558669----
ITSD_Valine-ME558670----
UreaUreaME558671----
NorvalineNorvalineME558672----
Acetoacetic acid2Acetoacetic acidME558673----
DihydroxyacetoneDihydroxyacetoneME558674----
Benzoic acidBenzoic acidME558675----
Caprylic acidCaprylic acidME558676----
GlycerolGlycerolME558677----
Ethanolamine2EthanolamineME558679----
L-LeucineLeucineME558680----
ISTD_Leucine-ME558681----
Phosphoric acidPhosphoric acidME558682----
L-IsoleucineIsoleucineME558683----
Nicotinic acidNicotinic acidME558684----
Maleic acidMaleic acidME558685----
L-ProlineProlineME558686----
Succinic acidSuccinic acidME558687----
Glycine2GlycineME558688----
Methylsuccinic acidMethylsuccinic acidME558689----
Glyceric acidGlyceric acidME558690----
PyrocatecholPyrocatecholME558691----
Fumaric acidFumaric acidME558692----
UracilUracilME558693----
Itaconic acidItaconic acidME558694----
Pelargonic acidPelargonic acidME558695----
L-SerineSerineME558696----
L-ThreonineThreonineME558697----
Glutaric acidGlutaric acidME558698----
HydroquinoneHydroquinoneME558699----
ThymineThymineME558700----
Beta-Alanine2beta-AlanineME558701----
L-HomoserineHomoserineME558702----
Capric acidCapric acidME558703----
Citramalic acidCitramalic acidME558704----
Malic acidMalic acidME558705----
NiacinamideNiacinamideME558706----
Adipic acidAdipic acidME558707----
ErythritolErythritolME558708----
N-AcetylserineN-AcetylserineME558709----
Glutamate, gamma-methyl esterGlutamic acid, gamma-methyl esterME558710----
L-Aspartic acidAspartic acidME558711----
L-MethionineMethionineME558712----
4-Hydroxyprolinecis-4-HydroxyprolineME558713----
Pyroglutamic acidPyroglutamic acidME558714----
CytosineCytosineME558715----
Gamma-Aminobutyric acidgamma-Aminobutyric acidME558716----
1,2,3-Trihydroxybenzene1,2,3-TrihydroxybenzeneME558717----
L-CysteineCysteineME558718----
L-2-Hydroxyglutaric acid2-Hydroxyglutaric acidME558719----
Oxoglutaric acid2-Oxoglutaric acidME558720----
2-Isopropylmalic acid2-Isopropylmalic acidME558721----
Phenylpyruvic acidPhenylpyruvic acidME558722----
Pimelic acidPimelic acidME558723----
Phenyllactic acidPhenyllactic acidME558724----
Phosphoenolpyruvic acidPhosphoenolpyruvic acidME558725----
OrnithineOrnithineME558726----
Labelled compound_glutamic acid-ME558727----
TriethanolamineTriethanolamineME558728----
5-Aminopentanoic acid5-Aminopentanoic acidME558729----
L-PhenylalaninePhenylalanineME558730----
Dodecanoic acidLauric acidME558731----
N-Acetyl-L-aspartic acidN-Acetylaspartic acidME558732----
HomocysteineHomocysteineME558733----
L-AsparagineAsparagineME558734----
D-RibuloseD-RibuloseME558735----
D-RiboseRiboseME558736----
D-XyluloseL-RibuloseME558737----
3-Sulfinoalanine3-Sulfino-alanineME558738----
Suberic acidSuberic acidME558739----
LevoglucosanGlucosanME558740----
D-Glyceraldehyde 3-phosphateGlyceraldehyde 3-phosphateME558741----
Beta-Glycerophosphoric acidsn-Glycero-2-phosphateME558742----
D-ArabitolArabitolME558743----
RhamnoseRhamnoseME558744----
cis-Aconitic acidcis-Aconitic acidME558745----
2-Deoxyglucose2-Deoxy-glucoseME558746----
Orotic acidOrotic acidME558747----
PutrescinePutrescineME558748----
Glycerol 3-phosphatesn-Glycero-3-phosphateME558749----
N-AcetylputrescineN-AcetylputrescineME558750----
2-Phosphoglyceric acid2-Phosphoglyceric acidME558751----
Azelaic acidAzelaic acidME558752----
L-Dihydroorotic acid4,5-Dihydroorotic acidME558753----
O-PhosphoethanolaminePhosphoethanolamineME558754----
3-Phosphoglyceric acid3-Phosphoglyceric acidME558755----
2-Aminoheptanedioic acid-ME558756----
Citric acidCitric acidME558757----
L-ArginineArginineME558758----
Ornithine2OrnithineME558759----
Myristic acidMyristic acidME558760----
D-TagatoseD-TagatoseME558761----
Psicose_1PsicoseME558762----
Psicose_2PsicoseME558763----
Sebacic acidSebacic acidME558764----
GluconolactoneGluconolactoneME558765----
L-SorboseSorboseME558766----
D-GalactoseGalactoseME558767----
D-GlucoseGlucoseME558768----
N-AcetylglutamineN-AcetylglutamineME558769----
Ureidosuccinic acidN-Carbamoylaspartic acidME558770----
L-LysineLysineME558771----
D-Galactose2GalactoseME558772----
D-Glucose2GlucoseME558773----
1-HexadecanolCetyl alcoholME558774----
L-TyrosineTyrosineME558775----
MannitolMannitolME558776----
SorbitolSorbitolME558777----
ITSD_Sorbitol-ME558778----
Pantothenic acidPantothenic acidME558779----
Palmitoleic acidPalmitoleic acidME558780----
XanthineXanthineME558781----
Gluconic acidGluconic acidME558782----
Palmitic acidPalmitic acidME558783----
N-AcetylmannosamineN-Acetyl-mannosamineME558784----
N-Acetyl-D-glucosamineN-Acetyl-D-glucosamineME558785----
D-Ribose 5-phosphateRibose 5-phosphateME558786----
myo-InositolMyo-inositolME558787----
D-Ribose 5-phosphate2Ribose 5-phosphateME558788----
Heptadecanoic acidMargaric acidME558789----
OctadecanolStearyl alcoholME558790----
Glutathione-nTMSGlutathioneME558791----
Linoleic acidLinoleic acidME558792----
Oleic acidOleic acidME558793----
Elaidic acidElaidic acidME558794----
Stearic acidStearic acidME558795----
TryptamineTryptamineME558796----
Glucose 6-phosphateGlucose 6-phosphateME558797----
Glucose 6-phosphate2Glucose 6-phosphateME558798----
StigmasterolStigmasterolME558799----
D-Sedoheptulose 7-phosphateD-Sedoheptulose 7-phosphateME558800----
AdenosineAdenosineME558801----
SucroseSucroseME558802----
MG(18:0e/0:0/0:0)MG O-18:0ME558803----
TrehaloseTrehaloseME558804----
D-MaltoseMaltoseME558805----
LactitolLactitolME558808----
D-Maltose2MaltoseME558809----


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