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Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
Acylcarnitine C16:0CAR 16:0ME11411611953816C029901.686400.3432
Acylcarnitine C18:0CAR 18:0ME11411752922056-2.446428.3732
Acylcarnitine C18:1CAR 18:1ME1141186441392-1.873426.3578
CE (18:2)CE 18:2ME1141195287939C1544110.577671.5742
Ceramide (d42:1)_1Cer 42:1;O2ME1141205283571-8.443632.6309
Ceramide (d42:1)_2Cer 42:1;O2ME1141215283571-8.478672.6247
Ceramide (d42:2)Cer 42:2;O2ME1141225283568-7.831670.6135
DG (34:1)DG 34:1ME114123--7.0875617.5124
DG (34:2)DG 34:2ME114124--6.5485615.4965
DG (36:1)DG 36:1ME114125--7.76640.5914
DG (36:2)DG 36:2ME114126--7.169643.5315
DG (36:3)DG 36:3ME114127--6.6125636.556
DG (36:4)DG 36:4ME114128--6.076617.5145
DG (38:5)DG 38:5ME114129--6.462660.5566
DG (38:6)DG 38:6ME114130--5.918658.5398
DG (40:7)DG 40:7ME114131--6.246689.5163
LPC (16:0)LPC 16:0ME114132460602C042301.603496.3405
LPC (16:1)LPC 16:1ME114133--1.219494.3245
LPC (18:0)LPC 18:0ME114134--2.3775524.3719
LPC (18:1)LPC 18:1ME114135--1.774522.3559
LPC (18:2)LPC 18:2ME114136--1.3465542.3229
LPC (20:1)LPC 20:1ME114137--2.52550.3872
LPC (20:4)LPC 20:4ME114138--1.294544.3405
LPC (o-16:0)LPC O-16:0ME114139162126C139031.87482.3616
LPC (p-18:0) or LPC (o-18:1)LPC P-18:0 or LPC O-18:1ME114140--2.03508.3765
PC (30:0)PC 30:0ME114141--4.9415706.5401
PC (30:1)PC 30:1ME114142--4.411704.5264
PC (31:0)PC 31:0ME114143--5.244720.5595
PC (32:0)PC 32:0ME114144--5.571734.5708
PC (32:1)PC 32:1ME114145--5.015732.5552
PC (32:2)PC 32:2ME114146--4.553730.5383
PC (33:0)PC 33:0ME114147--5.797748.5828
PC (33:1)PC 33:1ME114148--5.336746.5709
PC (33:2)PC 33:2ME114149--4.858744.5556
PC (34:0)PC 34:0ME114150--6.247762.601
PC (34:1)PC 34:1ME114151--5.6665760.5835
PC (34:2)PC 34:2ME114152--5.1715758.5703
PC (34:3)PC 34:3ME114153--4.73756.5546
PC (34:4)PC 34:4ME114154--4.47754.5385
PC (35:1)PC 35:1ME114155--6.007774.595
PC (35:2)PC 35:2ME114156--5.483772.5867
PC (35:3)PC 35:3ME114157--4.94770.5696
PC (35:4)PC 35:4ME114158--4.763768.555
PC (36:1)PC 36:1ME114159--6.3185788.6178
PC (36:2)PC 36:2ME114160--5.806786.6015
PC (36:3)PC 36:3ME114161--5.2475784.5831
PC (36:4)PC 36:4ME114162--5.073782.5696
PC (36:5)PC 36:5ME114163--4.67780.5541
PC (37:2)PC 37:2ME114164--6.141800.6159
PC (37:3)PC 37:3ME114165--5.668798.5884
PC (37:4)PC 37:4ME114166--5.404796.59
PC (38:2)PC 38:2ME114167--6.384836.6188
PC (38:3)PC 38:3ME114168--5.993812.6151
PC (38:4)PC 38:4ME114169--5.715810.6006
PC (38:5)PC 38:5ME114170--5.154808.5841
PC (38:6)PC 38:6ME114171--4.677806.5692
PC (40:4)PC 40:4ME114172--6.184838.6323
PC (40:5)PC 40:5ME114173--5.734836.6151
PC (40:6)PC 40:6ME114174--5.524834.5999
PC (40:7)PC 40:7ME114175--4.9655832.5846
PC (40:8)PC 40:8ME114176--4.54830.5708
PC (42:5)PC 42:5ME114177--6.174864.6515
PC (42:7)PC 42:7ME114178--5.452882.5893
PC (o-34:0)PC O-34:0ME114179--6.626748.6136
PC (p-32:0) or PC (o-32:1)PC P-32:0 or PC O-32:1ME114180--5.938718.5716
PC (p-34:0) or PC (o-34:1)PC P-34:0 or PC O-34:1ME114181--6.045746.6022
PC (p-34:1) or PC (o-34:2)PC P-34:1 or PC O-34:2ME114182--5.528744.5899
PC (p-36:1) or PC (o-36:2)PC P-36:1 or PC O-36:2ME114183--6.156772.6218
PC (p-36:2) or PC (o-36:3)PC P-36:2 or PC O-36:3ME114184--5.6505753.5728
PC (p-36:3) or PC (o-36:4)PC P-36:3 or PC O-36:4ME114185--5.449768.5872
PC (p-38:2) or PC (o-38:3)PC P-38:2 or PC O-38:3ME114186--6.383798.6361
PC (p-38:3) or PC (o-38:4)PC P-38:3 or PC O-38:4ME114187--6.093796.6173
PC (p-38:4) or PC (o-38:5)PC P-38:4 or PC O-38:5ME114188--5.4885794.6018
PC (p-38:5) or PC (o-38:6)PC P-38:5 or PC O-38:6ME114189--5.528792.5933
PC (p-40:3) or PC (o-40:4)PC P-40:3 or PC O-40:4ME114190--6.825824.6544
PC (p-40:4) or PC (o-40:5)PC P-40:4 or PC O-40:5ME114191--6.119822.6302
PC (p-40:5) or PC (o-40:6)PC P-40:5 or PC O-40:6ME114192--5.775820.6246
PC (p-40:6) or PC (o-40:7)PC P-40:6 or PC O-40:7ME114193--5.244818.6089
PC (p-42:3) or PC (o-42:4)PC P-42:3 or PC O-42:4ME114194--7.481852.6868
PC (p-42:4) or PC (o-42:5)PC P-42:4 or PC O-42:5ME114195--6.755850.6632
PC (p-42:5) or PC (o-42:6)PC P-42:5 or PC O-42:6ME114196--6.287848.6568
PC (p-44:4) or PC (o-44:5)PC P-44:4 or PC O-44:5ME114197--7.399878.6993
PE (34:2)PE 34:2ME114198--5.3375716.5291
PE (36:1)PE 36:1ME114199--6.5225746.5713
PE (38:4)PE 38:4ME114200--5.881768.5583
PE (p-36:4) or PE (o-36:5)PE P-36:4 or PE O-36:5ME114201--5.517724.5286
PE (p-38:4) or PE (o-38:5)PE P-38:4 or PE O-38:5ME114202--6.159752.5576
PE (p-38:5) or PE (o-38:6)PE P-38:5 or PE O-38:6ME114203--5.571750.545
PE (p-40:5) or PE (o-40:6)PE P-40:5 or PE O-40:6ME114204--6.433778.5809
SM (d32:1)SM 32:1;O2ME114205--4.253675.5421
SM (d33:1)SM 33:1;O2ME114206--4.549689.5578
SM (d34:0)SM 34:0;O2ME114207--5.081705.5895
SM (d34:1)SM 34:1;O2ME114208--4.8735703.5739
SM (d34:2)SM 34:2;O2ME114209--4.351701.5578
SM (d36:1)SM 36:1;O2ME114210--5.518731.6042
SM (d40:1)SM 40:1;O2ME114211--6.906787.6677
SM (d41:1)SM 41:1;O2ME114212--7.236801.6809
SM (d42:1)SM 42:1;O2ME114213--7.573815.6991
SM (d42:2)SM 42:2;O2ME114214--6.881813.6836
TG (42:1)TG 42:1ME114215--9.136743.6177
TG (44:1)TG 44:1ME114216--9.5715771.6446
TG (46:0)TG 46:0ME114217--10.584796.7391
TG (48:0)_1TG 48:0ME114218--10.94829.7263
TG (48:0)_2TG 48:0ME114219--10.969824.7705
TG (48:1)TG 48:1ME114220--10.594827.7107
TG (48:2)TG 48:2ME114221--10.1995820.7393
TG (49:0)TG 49:0ME114222--11.1965843.7448
TG (49:1)TG 49:1ME114223--10.799836.7707
TG (49:2)TG 49:2ME114224--10.423834.7546
TG (50:0)TG 50:0ME114225--11.337852.7993
TG (50:1)TG 50:1ME114226--11.0015855.7418
TG (50:2)TG 50:2ME114227--10.635853.7267
TG (50:3)TG 50:3ME114228--10.2405851.7107
TG (50:4)TG 50:4ME114229--9.8265849.6948
TG (51:1)TG 51:1ME114230--11.193864.8009
TG (51:2)TG 51:2ME114231--10.844862.7856
TG (51:3)TG 51:3ME114232--10.455860.7698
TG (51:4)TG 51:4ME114233--10.068858.7544
TG (52:0)TG 52:0ME114234--11.744880.8321
TG (52:1)TG 52:1ME114235--11.391883.7727
TG (52:2)TG 52:2ME114236--11.026881.7576
TG (52:3)TG 52:3ME114237--10.661879.7421
TG (52:4)TG 52:4ME114238--10.2885877.7267
TG (52:5)TG 52:5ME114239--9.935870.7548
TG (52:6)TG 52:6ME114240--9.5915868.7382
TG (53:2)TG 53:2ME114241--11.227895.7747
TG (53:3)TG 53:3ME114242--10.866888.8008
TG (53:4)TG 53:4ME114243--10.5145886.7851
TG (54:1)TG 54:1ME114244--11.7445911.8057
TG (54:2)TG 54:2ME114245--11.4085904.8337
TG (54:3)TG 54:3ME114246--11.0535902.8162
TG (54:4)TG 54:4ME114247--10.696900.7996
TG (54:5)TG 54:5ME114248--10.3195898.7835
TG (54:6)TG 54:6ME114249--9.9365901.7271
TG (54:7)TG 54:7ME114250--9.552899.7122
TG (54:8)TG 54:8ME114251--9.1795892.7399
TG (56:1)TG 56:1ME114252--11.9325934.8813
TG (56:2)TG 56:2ME114253--11.769937.8222
TG (56:3)TG 56:3ME114254--11.4275930.8484
TG (56:4)TG 56:4ME114255--11.081933.7909
TG (56:5)TG 56:5ME114256--10.736931.7761
TG (58:1)TG 58:1ME114257--12.023962.9055
TG (58:2)TG 58:2ME114258--11.943965.8514
TG (58:3)TG 58:3ME114259--11.7805963.8371
TG (58:4)TG 58:4ME114260--11.4905961.8227
TG (60:2)TG 60:2ME114261--12.0365988.919


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
Ceramide (d32:1)Cer 32:1;O2ME114302--5.098544.4497
Ceramide (d33:1)Cer 33:1;O2ME114303--5.44558.4653
Ceramide (d34:0)Cer 34:0;O2ME114304--6.055598.5348
Ceramide (d34:1)Cer 34:1;O2ME114305--5.783596.5262
Ceramide (d34:2)_1Cer 34:2;O2ME114306--5.187570.4694
Ceramide (d34:2)_2Cer 34:2;O2ME114307--5.212594.5052
Ceramide (d36:1)Cer 36:1;O2ME114308--6.486600.5122
Ceramide (d38:1)Cer 38:1;O2ME114309--7.194628.5434
Ceramide (d40:0)_1Cer 40:0;O2ME114310--8.076658.5889
Ceramide (d40:0)_2Cer 40:0;O2ME114311--7.855682.6299
Ceramide (d40:1)Cer 40:1;O2ME1143125283567-7.849656.5744
Ceramide (d40:2)Cer 40:2;O2ME114313--7.242678.601
Ceramide (d41:1)Cer 41:1;O2ME114314--8.179670.5898
Ceramide (d42:0)_1Cer 42:0;O2ME114315--8.701686.6196
Ceramide (d42:0)_2Cer 42:0;O2ME114316--8.487710.6647
Ceramide (d42:2)Cer 42:2;O2ME1143175283568-7.819706.6342
Ceramide (d43:1)Cer 43:1;O2ME114318--8.783698.6216
Ceramide (d44:1)Cer 44:1;O2ME114319--9.0725736.6812
FA (14:0) [Myristic acid)Myristic acidME11432011005C064241.653227.2017
FA (17:0) [Margaric acid)Margaric acidME11432110465-2.988269.2487
FA (18:3) (linolenic acid)Octadecatrienoic acidME1143225280933C064261.61277.2174
FA (20:1) (eicosenoic acid)Eicosenoic acidME114323--3.371309.28
FA (20:3) (ho[Mo-ga[M[Ma-linolenic acid)Dihomo-gamma-linolenic acidME1143245280581C032422.424305.2488
FA (20:5) (eicosapentaenoic acid)Eicosapentaenoic acidME114325446284C064281.517301.2176
FA (22:0) (behenic acid)Behenic acidME1143268215C082814.536339.3269
FA (22:1) (erucic acid)cis-Erucic acidME114327--3.922337.3113
FA (22:6) (docosahexaenoic acid)Docosahexaenoic acidME114328445580C064291.734327.2332
FA (24:0) (lignoceric acid)Lignoceric acidME11432911197C083205.27367.3581
FA (24:1) (nervonic acid)Nervonic acidME114330--4.556365.3425
FA (26:0) (cerotic acid)Cerotic acidME11433110469-6.053395.3893
FA (28:0) [Montanic acid)Montanic acidME11433210470-6.845423.4205
GlcCer(d14:1(4E)/20:0(2OH))GlcCer 14:1;O2(4E)/20:0;OME11433370699246-4.981774.5718
LPC (16:0)LPC 16:0ME114334460602C042301.542554.3462
LPC (18:0)LPC 18:0ME114335--2.335582.3775
LPC (18:1)LPC 18:1ME114336--1.698580.3615
LPC (18:2)LPC 18:2ME114337--1.282578.3456
LPE (16:0)LPE 16:0ME114338--1.567452.2781
LPE (18:2)LPE 18:2ME114339--1.283476.2778
LPE (20:4)LPE 20:4ME114340--1.215500.2778
PC (32:0)PC 32:0ME114341--5.622792.5749
PC (32:1)PC 32:1ME114342--5.07790.5597
PC (32:2)PC 32:2ME114343--4.593788.5433
PC (34:1)PC 34:1ME114344--5.698794.5522
PC (34:2)PC 34:2ME114345--5.2055792.5339
PC (34:3)PC 34:3ME114346--4.766814.5592
PC (35:1)PC 35:1ME114347--6.027832.6024
PC (36:1)PC 36:1ME114348--6.366846.6227
PC (36:2)PC 36:2ME114349--5.858844.6068
PC (36:3)PC 36:3ME114350--5.341842.5908
PC (36:4)PC 36:4ME114351--5.1840.5755
PC (36:5)PC 36:5ME114352--4.707838.5591
PC (38:3)PC 38:3ME114353--6.026870.6217
PC (38:4)PC 38:4ME114354--5.748868.6069
PC (38:5)PC 38:5ME114355--5.186866.5902
PC (38:6)PC 38:6ME114356--4.972864.5731
PC (p-34:0) or PC (o-34:1)PC P-34:0 or PC O-34:1ME114357--6.083804.6097
PC (p-34:1) or PC (o-34:2)PC P-34:1 or PC O-34:2ME114358--5.587802.5955
PC (p-36:1) or PC (o-36:2)PC P-36:1 or PC O-36:2ME114359--6.177830.6318
PC (p-36:3) or PC (o-36:4)PC P-36:3 or PC O-36:4ME114360--5.481826.5949
PC (p-36:4) or PC (o-36:5)PC P-36:4 or PC O-36:5ME114361--5.373824.5814
PC (p-40:1) or PC (o-40:2)PC P-40:1 or PC O-40:2ME114362--6.852886.696
PE (34:1)PE 34:1ME114363--5.844716.523
PE (36:1)PE 36:1ME114364--5.72744.5528
PE (36:2)PE 36:2ME114365--5.987742.5372
PE (36:3)PE 36:3ME114366--5.426740.5227
PE (36:4)PE 36:4ME114367--5.226738.507
PE (38:2)PE 38:2ME114368--5.872770.5692
PE (38:4)_1PE 38:4ME114369--5.09766.5438
PE (38:4)_2PE 38:4ME114370--5.882766.5385
PE (p-34:1) or PE (o-34:2)PE P-34:1 or PE O-34:2ME114371--6.167700.5289
PE (p-34:2) or PE (o-34:3)PE P-34:2 or PE O-34:3ME114372--5.646698.5119
PE (p-36:1) or PE (o-36:2)PE P-36:1 or PE O-36:2ME114373--6.838728.5601
PE (p-36:2) or PE (o-36:3)PE P-36:2 or PE O-36:3ME114374--6.26726.5437
PE (p-36:4) or PE (o-36:5)PE P-36:4 or PE O-36:5ME114375--5.511722.5122
PE (p-36:5) or PE (o-36:6)PE P-36:5 or PE O-36:6ME114376--5.061720.497
PE (p-38:3) or PE (o-38:4)PE P-38:3 or PE O-38:4ME114377--6.291752.5567
PE (p-38:4) or PE (o-38:5)PE P-38:4 or PE O-38:5ME114378--6.188750.5434
PE (p-38:5) or PE (o-38:6)PE P-38:5 or PE O-38:6ME114379--5.571748.5277
PE (p-40:6) or PE (o-40:7)PE P-40:6 or PE O-40:7ME114380--5.984774.54
PE (p-40:7) or PE (o-40:8)PE P-40:7 or PE O-40:8ME114381--5.42772.5341
SM (d34:0)SM 34:0;O2ME114382--5.116763.5925
SM (d34:1)SM 34:1;O2ME114383--4.886761.5799
SM (d40:1)SM 40:1;O2ME114384--6.931845.6717
SM (d42:1)SM 42:1;O2ME114385--7.634873.7026
SM (d42:2)SM 42:2;O2ME114386--6.916871.6889


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