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Name
Formula / Structure
ExactMass
ID
alpha-D-Glucopyranosyl-alpha-D-glucopyranoside dih...
3 spectra
C12H22O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
342.29700
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS020207
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS020208
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS020209
alpha-D-Glucose 1-phosphate
1 spectrum
C6H13O9P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.02972
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100891
alpha-D-Glucose 6-phosphate
8 spectra
C6H13O9P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.02972
LC-ESI-ITFT; MS2; m/z:152.00; NEG
MSBNK-NAIST-KNA00725
LC-ESI-ITFT; MS2; m/z:154.02; POS
MSBNK-NAIST-KNA00337
LC-ESI-ITFT; MS2; m/z:171.15; POS
MSBNK-NAIST-KNA00338
LC-ESI-ITFT; MS2; m/z:259.02; NEG
MSBNK-NAIST-KNA00726
LC-ESI-ITFT; MS2; m/z:261.04; POS
MSBNK-NAIST-KNA00339
LC-ESI-ITFT; MS2; m/z:519.05; NEG
MSBNK-NAIST-KNA00727
LC-ESI-ITFT; MS; NEG
MSBNK-NAIST-KNA00724
LC-ESI-ITFT; MS; POS
MSBNK-NAIST-KNA00336
alpha-D-Glucose-1,6-diphosphate
1 spectrum
C6H14O12P2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
339.99606
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100628
alpha-D-Glucose-1,6-diphosphate potassium salt hy...
2 spectra
C6H14O12P2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.11801
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT103770
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT203770
alpha-D-Glucose-1,6-diphosphate potassium salt hy...
4 spectra
C6H14O12P2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.11801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS037703
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS037707
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS037708
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS037709
alpha-D-lactobiose, Lac, (Gal(beta1-4)Glc) , alpha...
3 spectra
C12H22O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
342.29700
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS037901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS037902
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS037903
alpha-D-Mannopyranosyl phosphate, [(2R,3S,4S,5S,6R...
1 spectrum
C6H13O9P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.13699
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT204860
alpha-D-Mannopyranosyl phosphate, alpha-Man-1P, al...
5 spectra
C6H13O9P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.13699
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS048601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS048602
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS048607
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS048608
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS048610
alpha-Dihydrolysergol
5 spectra
C16H20N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
256.35059
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01075
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01074
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01073
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01076
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000070
alpha-Echinenone
2 spectra
C40H54O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
550.41748
FAB-EBEB; MS2; m/z: 550.42; [M]+*
MSBNK-Kyoto_Univ-CA000054
LC-ESI-QTOF; MS2; POSITIVE; ESI; [M+H]+; CE 30 V
MSBNK-MSSJ-MSJ00110
alpha-Ergocryptine
4 spectra
C32H41N5O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
575.31079
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80723
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80722
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80721
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80720
alpha-Estradiol
7 spectra
C18H24O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
272.17764
LC-APPI-QQ; MS
MSBNK-PFOS_research_group-FFF00117
LC-APPI-QQ; MS2; CE:10 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00116
LC-APPI-QQ; MS2; CE:20 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00115
LC-APPI-QQ; MS2; CE:30 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00114
LC-APPI-QQ; MS2; CE:40 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00113
LC-APPI-QQ; MS2; CE:50 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00112
LC-APPI-QQ; MS2; CE:60 V; [M-H2O+H]+
MSBNK-PFOS_research_group-FFF00111
ALPHA-ETHY-ALPHA-PHENYLACETIC ACID TRIMETHYLSILYL ...
1 spectrum
C13H20O2Si
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
236.12326
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001094
ALPHA-ETHYL-ALPHA-PHENYLACETIC ACID TRIMETHYLSILYL...
1 spectrum
C13H20O2Si
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
236.12326
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001905
ALPHA-FARNESENE
2 spectra
C15H24
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.18781
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002833
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007577
ALPHA-FENCHYL ACETATE
1 spectrum
C12H20O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.14633
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007162
ALPHA-GUAIENE
1 spectrum
C15H24
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.18781
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002834
ALPHA-GURJUNENE
1 spectrum
C15H24
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.18781
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002836
alpha-Hederin
29 spectra
C41H66O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
750.96698
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301873
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301874
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301875
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301876
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301877
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301878
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301879
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301880
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301881
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301882
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301883
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305407
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305408
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305409
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305410
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305411
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305412
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305413
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305414
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305415
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305416
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305417
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305418
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305419
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305420
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR305421
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308664
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308671
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310396
ALPHA-HEXYLCINNAMALDEHYDE
1 spectrum
C15H20O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
216.15141
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008718
ALPHA-HIMACHALENE
1 spectrum
C15H24
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.18781
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002838
Alpha-hydroxy-metoprolol
16 spectra
C15H25NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
283.17841
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311096154
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311096158
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311096164
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311096162
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311096165
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311096153
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311096160
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311096157
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311096163
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311096156
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311096159
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311096166
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311096152
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311096161
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311096167
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311096155
alpha-Hydroxyhippuric acid
6 spectra
C9H9NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
195.05321
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP015901
LC-ESI-QTOF; MS2; CE: 10; R=; [M-H]-
MSBNK-BGC_Munich-RP015911
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP015902
LC-ESI-QTOF; MS2; CE: 20; R=; [M-H]-
MSBNK-BGC_Munich-RP015912
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP015903
LC-ESI-QTOF; MS2; CE: 40; R=; [M-H]-
MSBNK-BGC_Munich-RP015913
alpha-Hydroxyhydrocinnamic acid, DL-3-Phenyllactic...
2 spectra
C9H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.17599
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS098707
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS098708
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