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Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,3-DihydroxyacetoneDihydroxyacetoneME228915----
1,4:3,6-Dianhydroglucitol-ME228916----
1,5-Anhydroglucitol1,5-AnhydrosorbitolME228917----
1-DodecanolDodecanolME228918----
1-Eicosanol/Nonadecanoic acid-ME228919----
2-Aminoadipic acidalpha-Aminoadipic acidME228920----
2-DeoxyuridineDeoxyuridineME228921----
2-Ethylhexanoic acidalpha-Ethylcaproic acidME228922----
2-Hydroxybutyric acid2-Hydroxybutyric acidME228923----
2-Hydroxyglutaric acid2-Hydroxyglutaric acidME228924----
2-Hydroxypyridine2-HydroxypyridineME228925----
2-Ketoisoleucine-ME228926----
2-Ketoleucine-ME228927----
2-Ketovaline-ME228928----
2-Phenylacetic acidPhenylacetic acidME228929----
3-(3-Hydroxyphenyl)propionic acid3-(3-Hydroxyphenyl)propanoic acidME228930----
3-(4-Hydroxyphenyl)propionic acidDesaminotyrosineME228931----
3-Aminoisobutyric acid/beta-Alanine-ME228932----
3-Indolelactic acid/Tryptophan-ME228933----
3-Nitrotyrosine, but more likely tryptophan-ME228934----
4-Hydroxymandelic acid4-Hydroxymandelic acidME228935----
4-Hydroxyphenylacetic acid4-Hydroxyphenylacetic acidME228936----
4-Hydroxypyridine4-PyridoneME228937----
5-alpha-Coprostanol or similar oxysterol-ME228938----
5-Hydroxylysine5-HydroxylysineME228939----
6-Deoxyhexose-ME228940----
6-Hydroxynicotinic acid6-Hydroxynicotinic acidME228941----
Acetoacetate/2-Aminoisobutanoic acid-ME228942----
Acetylsalicylic acid/Salicylic acidAspirinME228943----
Adenosine/Inosine-ME228944----
AlanineAlanineME228945----
Aldopentoses-ME228946----
AlizarinAlizarinME228947----
AllantoinAllantoinME228948----
alpha Ketoglutaric acid2-Oxoglutaric acidME228949----
alpha-MonopalmitinMG 16:0/0:0/0:0ME228950----
alpha-MonostearinMG 18:0/0:0/0:0ME228951----
alpha-Tocopherolalpha-TocopherolME228952----
Aminomalonic acidAminomalonic acidME228953----
Arachidic acid/ 1-Heneicosanol-ME228954----
Arachidonic acid (also Eicosapentaenoic acid)Arachidonic acidME228955----
ArginineArginineME228956----
AsparagineAsparagineME228957----
Aspartic acidAspartic acidME228958----
Azelaic acidAzelaic acidME228959----
Benzoic acidBenzoic acidME228960----
beta-Hydroxybutyric acid3-Hydroxybutyric acidME228961----
beta-MonopalmitinMG 0:0/16:0/0:0ME228962----
beta-MonostearinMG 0:0/18:0/0:0ME228963----
beta-SitosterolSitosterolME228964----
Butyro-1,4-lactam-ME228965----
C10 hydrocarbon-ME228966----
C11 hydrocarbon-ME228967----
C12 hydrocarbon-ME228968----
C13 hydrocarbon-ME228969----
C14 Hydrocarbon-ME228970----
C15 hydrocarbon-ME228971----
C16 Hydrocarbon-ME228972----
C17 hydrocarbon-ME228973----
C20 Hydrocarbon-ME228974----
C21 Hydrocarbon-ME228975----
C22 hydrocarbon-ME228976----
C23 Hydrocarbon-ME228977----
C25 hydrocarbon-ME228978----
CampesterolCampesterolME228979----
CarnitineCarnitineME228980----
CholesterolCholesterolME228981----
Cholic acid or similar bile acid-ME228982----
Citric acid/isocitric acidCitric acid/Isocitric acidME228983----
CreatinineCreatinineME228984----
CystineCystineME228985----
Decanoic acidCapric acidME228986----
Dehydroalanine (possibly from cysteine)2-Aminoacrylic acidME228987----
Dehydroascorbic acid (possibly alpha-ketoglutarate...L-Dehydroascorbic acidME228988----
deuterated Myristic Acid (RTL std)-ME228989----
DiethanolamineDiethanolamineME228990----
Disaccharide-ME228991----
Docosahexaenoic acidDocosahexaenoic acidME228992----
Docosanoic acidBehenic acidME228993----
Eicosapentaenoic acidEicosapentaenoic acidME228994----
Erythritol/TheitolErythritolME228995----
Erythronic acidErythronic acidME228996----
EthanolamineEthanolamineME228997----
Flavonoid or short-chain cholesterol ester-ME228998----
Fructose-6-phosphateFructose 6-phosphateME229000----
Fructose or similar ketohexoseKetohexoseME228999----
FucosterolIsofucosterolME229001----
Fumaric acidFumaric acidME229002----
gamma-Hydroxybutyric acid4-Hydroxybutyric acidME229003----
gamma-Tocopherolgamma-TocopherolME229004----
Gluconic acid or similar sugar acid-ME229005----
Glucose-6-phosphate or similarHexose 6-phosphateME229007----
Glucose and other aldohexosesHexoseME229006----
Glutamic acidGlutamic acidME229008----
GlutamineGlutamineME229009----
Glutaric acidGlutaric acidME229010----
Glyceric acidGlyceric acidME229011----
GlycerolGlycerolME229012----
Glycerol 1-phosphatesn-Glycero-3-phosphateME229013----
GlycineGlycineME229014----
Glycolic acidGlycolic acidME229015----
Glyoxylic acidGlyoxylic acidME229016----
GuanineGuanineME229017----
GuanosineGuanosineME229018----
Heptadecanoic acid/Octadecanol-ME229019----
Hexanoic acid (and/or Glycolic acid)Caproic acidME229020----
Hexitols-ME229021----
HexosamineGlucosamineME229022----
Hexuronic acidHexuronic acidME229023----
HomocysteineHomocysteineME229024----
HomoserineHomoserineME229025----
Hydroxyprolines-ME229026----
HypotaurineHypotaurineME229027----
HypoxanthineHypoxanthineME229028----
Inosine/Adenosine-ME229029----
Isoleucine/LeucineLeucine/IsoleucineME229030----
Ketopentose-5-phosphate-ME229031----
Lactic acidLactic acidME229032----
Lauric acidLauric acidME229033----
Linoleic acidLinoleic acidME229034----
LysineLysineME229035----
Maleic acidMaleic acidME229036----
Malic acidMalic acidME229037----
Malonic acidMalonic acidME229038----
MethionineMethionineME229039----
Methionine sulfoxideMethionine sulfoxideME229040----
Methyl eicosatrienoate/Methyl arachidonate-ME229041----
Methyl linoleateMethyl linoleateME229042----
Methyl oleateMethyl oleateME229043----
Methyl palmitate-ME229044----
Methyl stearateMethyl stearateME229045----
MSTFA artifact-ME229046----
MyoinositolMyo-inositolME229047----
Myoinositol-2-phosphatemyo-Inositol 2-phosphateME229048----
Myristic acid or PentadecanolMyristic acidME229049----
N-AcetylglycineN-AcetylglycineME229050----
N-AcetylleucineN-AcetylleucineME229051----
N-AcetyltryptophanN-Acetyl-tryptophanME229052----
N-AcetyltyrosineN-AcetyltyrosineME229053----
Nicotinic acidNicotinic acidME229054----
N-Methylalanine/2-Aminobutanoic acid/N-Ethylglycin...-ME229055----
N-Methylglutamic acidN-Methyl-glutamic acidME229056----
Nonanoic acidPelargonic acidME229057----
Octanoic acidCaprylic acidME229058----
Oleic acidOleic acidME229059----
O-MethylphosphateMethanolphosphateME229060----
O-PhosphocolaminePhosphoethanolamineME229061----
OrnithineOrnithineME229062----
Palmitic acidPalmitic acidME229063----
Palmitoleic acidPalmitoleic acidME229064----
Pantothenic acidPantothenic acidME229065----
Pentadecanoic acid/Hexadecanol-ME229066----
PentitolsArabitolME229067----
Pentonic acids-ME229068----
PhenolPhenolME229069----
PhenylalaninePhenylalanineME229070----
Phosphoric acidPhosphoric acidME229071----
p-Hydroxyphenyllactic acid-ME229072----
Pimelic acidPimelic acidME229073----
ProlineProlineME229074----
Prunetin or similar isoflavone-ME229075----
PseudouridinePseudouridineME229076----
Purine ribosideNebularineME229077----
PutrescinePutrescineME229078----
PyrophosphatePyrophosphateME229079----
Pyrrole -2-carboxylic acidPyrrole-2-carboxylic acidME229080----
Pyruvic acidPyruvic acidME229081----
Sebacic acidSebacic acidME229082----
SerineSerineME229083----
SerotoninSerotoninME229084----
Siloxanes_R1-ME229085----
Siloxanes_R10-ME229094----
Siloxanes_R11-ME229095----
Siloxanes_R2-ME229086----
Siloxanes_R3-ME229087----
Siloxanes_R4-ME229088----
Siloxanes_R5-ME229089----
Siloxanes_R6-ME229090----
Siloxanes_R7-ME229091----
Siloxanes_R8-ME229092----
Siloxanes_R9-ME229093----
SphingosineSphingosineME229096----
SqualeneSqualeneME229097----
StearamideStearamideME229098----
Stearic acidStearic acidME229099----
Succinic acidSuccinic acidME229100----
Sucrose and similar disaccharidesHexose disaccharideME229101----
Tetracosanoic acidLignoceric acidME229102----
Tetradecanedioic acidTetradecanedioic acidME229103----
Threonic acidThreonic acidME229104----
Threonic acid/erythronic acid-ME229105----
ThreonineThreonineME229106----
Threose/erythrose-ME229107----
TrisaccharideHexose trisaccharideME229108----
Tryptamine/Norepinephrine-ME229109----
TyrosineTyrosineME229110----
Unknown-possibly propylene glycol-ME229111----
UracilUracilME229112----
UreaUreaME229113----
Uric acidUric acidME229114----
UridineUridineME229115----
Urocanic acidUrocanic acidME229116----
ValineValineME229117----
XanthineXanthineME229118----
XanthosineXanthosineME229119----
Xanthurenic acidXanthurenic acidME229120----


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