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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
2-ketoadipic acidOxoadipic acidME27771771C00322331841100
methionine minor-ME277638--430778104
diacetone alcohol NISTDiacetone alcoholME27768931256-208867115
alanineAlanineME2777095950C00041240378116
arachidic acidArachidic acidME27770810467C06425856421117
behenic acidBehenic acidME2777058215C08281920648117
heptadecanoic acidMargaric acidME27766510465-751309117
isoheptadecanoic acid NIST15-Methylpalmitic acidME277656164860-737927117
lauric acidLauric acidME2776483893C02679547906117
nonadecanoic acidNonadecylic acidME27763312591C16535822782117
pelargonic acidPelargonic acidME2776268158C01601399229117
pentadecanoic acidPentadecylic acidME27762513849C16537674647117
stearic acidStearic acidME2776095281C01530787622117
2-hydroxypyrazinyl-2-propenoic acid ethyl ester NI...-ME2777185371086-493127121
methionine sulfoxideMethionine sulfoxideME277637158980C02989637588128
1-monopalmitinMG 16:0/0:0/0:0ME27772014900C01885901749129
beta-sitosterolSitosterolME277702222284C017531128225129
cholesterolCholesterolME2776965997C001871078536129
cholesterol NISTCholesterolME277695--994497129
isobutene glycol NISTIsobutene glycolME27765768410-229353129
zymosterolZymosterolME27759292746C054371088064129
lignoceric acidLignoceric acidME27764611197C08320978597132
butyrolactam NIST2-PyrrolidinoneME27770112025-277199142
ornithineOrnithineME27763088747248C00077619196142
spermidineSpermidineME2776121102C00315792924144
valineValineME2775946287C00183309359144
cerotinic acidCerotic acidME27769710469-1033286145
hydroxylamineHydroxylamineME277659787C00192250536146
linoleic acidLinoleic acidME2776455280450C01595777414150
lysineLysineME2776445962C00047663483156
oxoprolineOxoprolineME2776297405C01879485935156
piperidone2-PiperidinoneME27761912665-275603156
citrullineCitrullineME2776929750C00327621404157
isoleucineIsoleucineME2776556306C00407359251158
leucineLeucineME2776476106C00123346101158
fucoseFucoseME277681439650C02095578299160
hexuronic acidHexuronic acidME277661152867-667373160
isomaltoseIsomaltoseME277654439193C00252983199160
epsilon-caprolactamEpsilon-caprolactamME2776867768C06593353069170
thymidineThymidineME2776005789C00214349402170
1,3,5-trimethylcyanuric acid-ME277722--416269171
5-aminovaleric acid5-Aminopentanoic acidME277713138C00431536657174
5-methoxytryptamine5-MethoxytryptamineME2777121833C05659864466174
ethanolamineEthanolamineME277684700C00189344719174
glycyl prolineGly-ProME2776673013625-691357174
phenylethylaminePhenylethylamineME2776231001C05332510327174
putrescinePutrescineME2776181045C00138588119174
spermineSpermineME2776111103C00750926727174
methionineMethionineME2776396137C00073483560176
glycolic acidGlycolic acidME277668757C00160227215177
benzoic acidBenzoic acidME277704243C00180339067179
nicotinic acidNicotinic acidME277634938C00253353934180
glyceric acidGlyceric acidME277672439194C00258377495189
ureaUreaME2775951176C00086323728189
lactic acidLactic acidME277652612C01432219848191
lactoseLactoseME277650440995C00243935640191
caprylic acidCaprylic acidME277699379C06423343457201
tryptophanTryptophanME2775986305C00078780482202
1-monostearinMG 18:0/0:0/0:0ME27771924699D01947959214203
cellobioseCellobioseME2776986255C01971932179204
lactuloseLactuloseME27764911333C07064929908204
maltoseMaltoseME277642439186C00208946601204
shikimic acidShikimic acidME2776148742C00493611100204
glycerolGlycerolME277671753C00116344466205
hexadecylglycerol NISTMG O-16:0ME27766372733C13859867593205
dihydrocholesterolDihydrocholesterolME27768866066C129781082070215
hexitolSorbitolME277662453C00392704741217
isoriboseD-RibopyranoseME27765310975657-558730217
lyxitolL-ArabitolME277643439255C00532573587217
riboseRiboseME2776165779C00121553135217
sorbitolSorbitolME2776135780C00794667922217
xylitolXylitolME2775936912C00379567437217
phenylalaninePhenylalanineME2776246140C00079537804218
serineSerineME2776155951C00065395020218
threonineThreonineME2776016288C00188408777218
tyrosineTyrosineME2775976057C00082671252218
UDP GlcNAcUDP-N-acetylglucosamineME277596445675C00043627437226
sulfuric acidTG 16:0_18:1_18:1ME2776051118C00059282411227
capric acidCapric acidME2777002969C01571451790229
inosineInosineME2776586021C00294897434230
aspartic acidAspartic acidME2777065960C00049480387232
4-hydroxybutyric acid4-Hydroxybutyric acidME27771410413C00989325027233
adenosineAdenosineME27771060961C00212918039236
1,2,4-benzenetriol1,2,4-TrihydroxybenzeneME27772310787C02814521803239
dehydroabietic acidDehydroabietic acidME27769094391C12078850374239
pyrrole-2-carboxylic acidPyrrole-2-carboxylic acidME27761712473C05942394886240
dodecanolDodecanolME2776878193C02277507619243
fumaric acidFumaric acidME277680444972C00122390016245
glutamic acidGlutamic acidME27767433032C00025529100246
succinic acidSuccinic acidME2776071110C00042370608247
beta-alaninebeta-AlanineME277703239C00099435564248
glycineGlycineME277669750C00037368707248
stigmasterolStigmasterolME2776085280794C054421110837255
thymineThymineME2775991135C00178420133255
pinitolPinitolME277620164619C03844622466260
glutaric acidGlutaric acidME277673743C00489421596261
adenineAdenineME277711190C00147646534264
sucroseSucroseME2776065988C00089912704271
hydroxycarbamate NISTHydroxycarbamic acidME27766016639161-325318278
myristic acidMyristic acidME27763511005C06424634414285
galactonic acidGalactonic acidME277679128869C00880690882292
threonic acidThreonic acidME2776025460407C01620497572292
1-hexadecanolCetyl alcoholME2777212682C00823679596299
phosphoethanolaminePhosphoethanolamineME2776211015C00346603912299
4-aminobutyric acid4-Aminopentanoic acidME277715119C00334488730304
myo-inositolMyo-inositolME277636892C00137730022305
fructoseFructoseME277683439709C02336639442307
tagatoseD-TagatoseME277604439312C00795636627307
palmitoleic acidPalmitoleic acidME277627445638C08362706508311
palmitic acidPalmitic acidME277628985C00249713809313
phosphatePhosphoric acidME2776221004C00009345365314
fructose-6-phosphateFructose 6-phosphateME277682440641C05345804279315
conduritol-beta-epoxideConduritol epoxideME2776919989541-675635318
galactoseGalactoseME277678439357C00984648756319
glucoseGlucoseME27767664689C00221659798319
mannitolMannitolME2776406251C00392663215319
guanosineGuanosineME2776666802C00387954962324
taurineTaurineME2776031123C00245556690326
octadecanolStearyl alcoholME2776328221-755409327
gluconic acidGluconic acidME2776776857417C00800693148333
oleic acidOleic acidME277631445639C00712779120339
glycerol-alpha-phosphatesn-Glycero-3-phosphateME277670754C03189590747357
4',5-dihydroxy-7-glucosyloxyflavanoneNaringenin 7-O-beta-D-glucosideME27771692794C09099980985361
lactitolLactitolME277651157355C13542959541361
maltotrioseMaltotrioseME277641439586C018351176044361
ergosterolErgosterolME277685444679C016941100305363
cis-gondoic acidcis-Gondoic acidME2776935282768C16526851223367
glucose-6-phosphateGlucose 6-phosphateME2776755958C00092818275387
ciliatineCiliatineME277694339C03557588335398
hexadecaneHexadecaneME27766411006-52596485
arachidonic acidArachidonic acidME277707444899C0021983711591
squaleneSqualeneME277610638072C0075197623795


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