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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
1,5-anhydroglucitol1,5-AnhydrosorbitolME39704964960C07326633969217
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME39704523368901-397526241
2-hydroxyglutaric acid2-Hydroxyglutaric acidME39704443C02630506306247
3-hydroxybutyric acid3-Hydroxybutyric acidME39704192135C01089278632191
3-phosphoglycerate3-Phosphoglyceric acidME397040724C00597610734227
4-aminobutyric acid4-Aminopentanoic acidME397039119C00334488730304
alanineAlanineME3970375950C00041243971116
alpha-tocopherolalpha-TocopherolME396929638015C003761067809237
aminomalonateAminomalonic acidME397036100714C00872455754218
adenosine-5-monophosphateAMPME3970386083C000201041375315
arabitolArabitolME39703594154C01904570685217
arachidic acidArachidic acidME39703410467C06425856421117
arachidonic acidArachidonic acidME397033444899C0021983433991
asparagineAsparagineME3970326267C00152553078188
aspartic acidAspartic acidME3970315960C00049433075160
behenic acidBehenic acidME3970308215C08281920648117
benzoic acidBenzoic acidME397029243C00180339214179
beta-alaninebeta-AlanineME397028239C00099435564248
beta-gentiobiosebeta-GentiobioseME397027441422C08240973116204
capric acidCapric acidME3970252969C01571452386229
cellobioseCellobioseME3970246255C01971932179204
cholesterolCholesterolME3970235997C001871078536129
cis-gondoic acidcis-Gondoic acidME3970225282768C16526847372367
citric acidCitric acidME397021311C00158617342273
creatinineCreatinineME397020588C00791502599115
cysteineCysteineME3970195862C00097500158220
dehydroabietic acidDehydroabietic acidME39701894391C12078850374239
docosahexaenoic acidDocosahexaenoic acidME397017--90281991
tagatoseD-TagatoseME396933439312C00795636627307
isothreonic acidD-Threonic acidME396987151152C00639494605292
xylonolactone NISTD-Xylono-1,5-lactoneME396918439692C02266535176217
erythritolErythritolME397016222285C00503471922217
ethanolamineEthanolamineME397015--344675174
fructoseFructoseME397014439709C02336641863307
fructose-1-phosphateFructose 1-phosphateME397013439394C01094803180387
fructose-6-phosphateFructose 6-phosphateME397012440641C05345804279315
fumaric acidFumaric acidME397011444972C00122390775245
galactonic acidGalactonic acidME397010128869C00880690882292
glycerol-3-galactosideGalactosylglycerolME39700116048618C05401800205204
glucoseGlucoseME39700964689C00221659798319
glucose-1-phosphateGlucose 1-phosphateME39700865533C00103594647217
glucose-6-phosphateGlucose 6-phosphateME3970075958C00092818275387
glutamic acidGlutamic acidME39700633032C00025527086246
glutamineGlutamineME3970055961C00064600315156
glutathioneGlutathioneME397004124886C00051761296213
glyceric acidGlyceric acidME397003439194C00258377495189
glycerolGlycerolME397002753C00116344466205
glycineGlycineME396999750C00037368707248
glycolic acidGlycolic acidME396998757C00160227215177
hexoseHexoseME396995206C00738642640319
hexose-6-phosphateHexose 6-phosphateME396994208C02965806282387
hydroxylamineHydroxylamineME396993787C00192253158146
hypoxanthineHypoxanthineME396992790C00262619128265
inosine 5'-monophosphateIMPME3969908582C001301016811169
inosineInosineME3969916021C00294897184230
inositol-4-monophosphateInositol 4-phosphateME396989440043C03546845976315
isoleucineIsoleucineME3969886306C00407359081158
lactamideLactamideME39698694220-265698232
lactic acidLactic acidME396985612C01432217657191
lactitolLactitolME396984157355C13542959541361
lactobionic acidLactobionic acidME3969837314C04247972139204
lactoseLactoseME396982440995C00243935640191
lyxitolL-ArabitolME396977439255C00532573587217
lauric acidLauric acidME3969813893C02679547906117
leucineLeucineME3969806106C00123346101158
linoleic acidLinoleic acidME3969795280450C01595777414150
lysineLysineME3969785962C00047663483156
maleimideMaleimideME39697610935C07272245118154
malic acidMalic acidME396975525C00711463180233
maltoseMaltoseME396974439186C00208946601204
maltotrioseMaltotrioseME396973439586C018351176044361
mannitolMannitolME3969726251C00392663215319
mannoseMannoseME39697118950C00159645856205
heptadecanoic acidMargaric acidME39699710465-751309117
methanolphosphateMethanolphosphateME39697013130-289520241
methionineMethionineME3969696137C00073483560176
methionine sulfoxideMethionine sulfoxideME396968158980C02989637588128
2-monopalmitinMG 0:0/16:0/0:0ME397042123409-890356129
2-monooleinMG 0:0/18:1(9Z)/0:0ME3970435319879-941794129
1-monopalmitinMG 16:0/0:0/0:0ME39704714900C01885901749129
1-monostearinMG 18:0/0:0/0:0ME39704624699D01947959214203
1-monooleinMG 18:1(9Z)/0:0/0:0ME3970485283468-952623129
myo-inositolMyo-inositolME396967892C00137730022305
myristic acidMyristic acidME39696611005C06424634414285
N-acetylaspartic acidN-Acetylaspartic acidME39696565065C01042548028158
nicotinamideNiacinamideME396964936C00153471602179
nonadecanoic acidNonadecylic acidME39696312591C16535822782117
oleic acidOleic acidME396961445639C00712779120339
ornithineOrnithineME3969606262C00077527113142
oxalic acidOxalic acidME396959971C00209260513190
oxoprolineOxoprolineME3969587405C01879485935156
palmitic acidPalmitic acidME396957985C00249713809313
palmitoleic acidPalmitoleic acidME396956445638C08362704511311
pantothenic acidPantothenic acidME3969556613C12276690887291
parabanic acid NISTParabanic acidME39695467126C00802464991100
pelargonic acidPelargonic acidME3969538158C01601399229117
pentadecanoic acidPentadecylic acidME39695213849C16537674647117
phenylalaninePhenylalanineME3969516140C00079537804218
phosphoenolpyruvatePhosphoenolpyruvic acidME396949--518184211
phosphoethanolaminePhosphoethanolamineME3969481015C00346603912299
phosphatePhosphoric acidME3969501004C00009345365314
pinitolPinitolME396947164619C03844622466260
prolineProlineME396946145742C00148364716142
pyrophosphatePyrophosphateME3969451023C00013327517110
raffinoseRaffinoseME396944439242C004921120886361
ribitolRibitolME396943827C00474575497217
ribonic acidRibonic acidME3969425460677C01685599680292
riboseRiboseME396941--553078217
serineSerineME3969405951C00065395020218
beta-sitosterolSitosterolME397026222284C017531128225129
glycerol-alpha-phosphatesn-Glycero-3-phosphateME397000754C03189590747357
hexitolSorbitolME396996453C00392704741217
sorbitolSorbitolME3969395780C00794667922217
squaleneSqualeneME396938638072C0075197623795
stearic acidStearic acidME3969375281C01530787622117
octadecanolStearyl alcoholME3969628221-755409327
succinic acidSuccinic acidME3969361110C00042370608247
sucroseSucroseME3969355988C00089912704271
taurineTaurineME3969321123C00245556690326
sulfuric acidTG 16:0_18:1_18:1ME3969341118C00059282411227
threonic acidThreonic acidME3969315460407C01620497572292
threonineThreonineME3969306288C00188409568218
trans-4-hydroxyprolinetrans-4-HydroxyprolineME3969285810C01157484934140
tryptophanTryptophanME3969276305C00078780482202
tyrosineTyrosineME3969266057C00082671252218
uracilUracilME3969251174C00106385735241
ureaUreaME3969241176C00086326574189
uric acidUric acidME3969231175C00366730691441
uridineUridineME3969226029C00299861508217
valineValineME3969216287C00183313502144
xanthineXanthineME3969201188C00385701688353
xylitolXylitolME3969196912C00379567437217
xylulose NISTXyluloseME396917439205C00312553450173


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