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Analysis: GC POSITIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1-monopalmitinMG 16:0/0:0/0:0ME137712---371
2-deoxyerythritol2-DeoxyerythritolME137760---117
2-deoxytetronic acid nist2,4-Dihydroxybutanoic acidME137745---292
2-hydroxybutanoic acid2-Hydroxybutyric acidME137677---131
2-hydroxyglutaric acid2-Hydroxyglutaric acidME137738---247
2-hydroxyhippuric acidSalicyluric acidME137781---324
2-hydroxypyridine2-HydroxypyridineME137669---152
3-(3-hydroxyphenyl)propionic acid3-(3-Hydroxyphenyl)propanoic acidME137777---192
3,4-dihydroxycinnamic acidCaffeic acidME137758---219
3-hydroxybenzoic acid (likely)-ME137761---267
3-hydroxyphenylacetic acid3-Hydroxyphenylacetic acidME137783---164
4-hydroxy-3-methoxybenzoic acidVanillic acidME137778---297
4-hydroxybenzoic acid4-Hydroxybenzoic acidME137786---267
4-hydroxybutyric acid4-Hydroxybutyric acidME137744---233
4-hydroxypyridine4-PyridoneME137724---152
5-aminovaleric acid lactame2-PiperidinoneME137785---156
5-hydroxy-3-indoleacetic acid5-Hydroxyindoleacetic acidME137780---290
5-hydroxymethyl-2-furoic acid nistSumiki's acidME137782---123
alanineAlanineME137735---116
alpha-ketoglutarate2-Oxoglutaric acidME137683---198
aminomalonic acidAminomalonic acidME137722---218
arabinoseArabinoseME137684---217
arabitolArabitolME137772---217
arachidiic acidArachidic acidME137678---117
asparagine dehydratedAsparagineME137736---100
asparagine minorAsparagineME137742---159
aspartate minorAspartic acidME137699---160
azelaic acidAzelaic acidME137752---317
behenic acidBehenic acidME137728---117
benzoic acidBenzoic acidME137671---179
butane-2,3-diol nist2,3-ButanediolME137784---117
capric acidCapric acidME137692---229
caprylic acidCaprylic acidME137690---201
catechol (likely)PyrocatecholME137747---254
chlorogenic acid majorChlorogenic acidME137700---345
citraconic acid major TMS2-ME137764---147
citric acidCitric acidME137673---273
cyanoalanineCyanoalanineME137767---141
cyclohexylamine 1tmsCyclohexylamineME137691---128
cystineCystineME137718---218
enolpyruvate nistPhosphoenolpyruvic acidME137756---147
epsilon-caprolactam (likely)-ME137753---170
fructoseFructoseME137710---217
fructose 2FructoseME137709---217
fumaric acidFumaric acidME137739---245
gluconic acidGluconic acidME137769---333
glucoseGlucoseME137686---205
glucose 2GlucoseME137750---319
glucose-6-phosphate majorGlucose 6-phosphateME137697---387
glucose-6-phosphate minor-ME137705---387
glutamine 3TMS majorGlutamineME137719---156
glutamine dehydratedGlutamineME137770---227
glutaric acidGlutaric acidME137757---158
glyceric acidGlyceric acidME137708---189
glycerolGlycerolME137667---205
glycineGlycineME137665---174
glycolic acidGlycolic acidME137727---177
heptadecanoic acidMargaric acidME137681---117
hexanedioic acid, bis(2-ethylhexyl) ester nist (li...-ME137748---129
hexose pertms nistHexoseME137668---204
hippuric acid 2tmsHippuric acidME137763---105
histidine 2HistidineME137716---154
hydroxylamineHydroxylamineME137685---146
isoleucineIsoleucineME137717---158
isothreonic acid 2D-Threonic acidME137729---292
isothreonic acid 4D-Threonic acidME137682---292
itaconic acidItaconic acidME137746---147
lactic acidLactic acidME137687---117
lactobionic acid 1Lactobionic acidME137754---204
leucineLeucineME137713---158
levoglucosanGlucosanME137787---166
lysineLysineME137698---156
maleimideMaleimideME137711---154
malonic acidMalonic acidME137743---147
mannoseMannoseME137751---319
methionine (likely)MethionineME137766---176
methylmaleic acidCitraconic acidME137740---184
methyltetrahydrophenanthrenone2 nist-ME137679---197
myo-inositolMyo-inositolME137749---217
myristic acidMyristic acidME137675---285
n-acetyl-d-hexosamine 2N-AcetylhexosamineME137732---319
N-acetyl-L-aspartic acid 1N-Acetylaspartic acidME137695---158
N-acetyl-L-aspartic acid TMS3N-Acetylaspartic acidME137759---274
n-methylalanineN-MethylalanineME137723---130
octadecanolStearyl alcoholME137706---327
oleic acidOleic acidME137674---339
oxoprolineOxoprolineME137670---156
palmitic acidPalmitic acidME137765---313
pantothenic acidPantothenic acidME137733---291
pelargonic acidPelargonic acidME137676---215
pentadecanoic acidPentadecylic acidME137726---299
phenolPhenolME137688---151
phenylacetic acidPhenylacetic acidME137734---164
phenylalaninePhenylalanineME137775---218
phosphatePhosphoric acidME137662---299
phthalate ester-ME137672---149
phthalic acidPhthalic acidME137680---147
pipecolinic acidPipecolic acidME137773---156
possible sucrose-ME137755---204
prolineProlineME137714---142
pseudo-uridinePseudouridineME137725---217
putrescinePutrescineME137771---174
ribitolRibitolME137704---217
ribitol (likely)XylitolME137774---217
salicylic acidSalicylic acidME137694---267
serineSerineME137702---204
serine minorSerineME137696---116
shikimic acidShikimic acidME137693---204
sorbitolSorbitolME137720---319
stearic acidStearic acidME137663---117
succinic acidSuccinic acidME137731---147
threonineThreonineME137703---218
threoseThreoseME137762---205
trans-4-hydroxy-L-proline minor1trans-4-HydroxyprolineME137721---158
tryptophanTryptophanME137715---202
tyrosineTyrosineME137707---218
udp-glucuronic acidUDP-glucuronic acidME137776---217
uracilUracilME137737---241
uric acidUric acidME137701---441
valineValineME137689---144
valine 1tmsValineME137741---156
vanilylmandelic acid-ME137779---297
xylose 2XyloseME137730---103
z dioctylphtalate-ME137664---149
z mstfa artifact-ME137666---100
z polysiloxane-ME137768---429


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