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Name
Formula / Structure
ExactMass
ID
Carnitine
6 spectra
C7H15NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
161.10519
LC-ESI-IT; MS2; m/z: 162.2; [M+H]+
MSBNK-Metabolon-MT000082
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002557
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002558
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002559
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002560
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002561
Carpipramine
4 spectra
C28H38N4O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
446.30457
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA001867
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA001866
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA001865
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA001864
Carteolol
6 spectra
C16H24N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
292.17868
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA001952
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA001951
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA001950
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA001949
LC-ESI-Q; MS; POS; 75 V
MSBNK-Waters-WA001948
LC-ESI-Q; MS; POS; 90 V
MSBNK-Waters-WA001947
CARVACROL
2 spectra
C10H14O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
150.10448
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP000909
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP009219
CARVEOL(AXIAL)
1 spectrum
C10H16O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.12012
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001570
CARVEOL(EQUATRIAL)
1 spectrum
C10H16O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.12012
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001571
Carviolin
12 spectra
C16H12O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
300.06339
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003674
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003174
LC-ESI-ITFT; MS2; CE: 20%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003675
LC-ESI-ITFT; MS2; CE: 20%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003175
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003676
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003176
LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003677
LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003177
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003678
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003178
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003679
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M-H]-
MSBNK-HBM4EU-HB003179
CARVOMENTHOL
2 spectra
C10H20O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
156.15141
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP005221
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001568
CARVOMENTHOL(CIS-AXIAL)
1 spectrum
C10H20O
156.15141
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007389
CARVOMENTHOL(CIS-EQUATORIAL)
1 spectrum
C10H20O
156.15141
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007387
CARVOMENTHOL(TRANS-AXIAL)
1 spectrum
C10H20O
156.15141
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007386
CARVOMENTHOL(TRANS-EQUATORIAL)
1 spectrum
C10H20O
156.15141
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007388
CARVOMENTHONE
1 spectrum
C10H18O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
154.13577
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007394
CARVONE
1 spectrum
C10H14O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
150.10448
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP006601
CARVONE-1,6-OXIDE
1 spectrum
C10H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.09938
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP006611
CARVYL PROPIONATE
1 spectrum
C13H20O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
208.14633
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP006908
CARYOPHYLLA-3(12),7(13)-DIEN-6-OL
1 spectrum
C15H24O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
220.18272
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP010684
CARYOPHYLLENE
2 spectra
C15H24
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.18781
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007124
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007539
CARYOPHYLLENE ACETATE
1 spectrum
C17H28O2
264.20892
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008369
CARYOPHYLLENE ALCOHOL
1 spectrum
C15H26O
222.19836
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008387
Cashmeran
5 spectra
C14H22O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
206.16707
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-UFZ-WANA019311C9CFPH
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-UFZ-WANA019313D9F1PH
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-UFZ-WANA0193155BE0PH
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU244801
LC-ESI-QTOF; MS2; CE: Ramp 18.3-27.4 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU244806
Castanospermine
5 spectra
C8H15NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
189.10011
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002562
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002563
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002564
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002565
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002566
Casticin
5 spectra
C19H18O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
374.10016
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
MSBNK-Fiocruz-FIO00420
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
MSBNK-Fiocruz-FIO00421
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
MSBNK-Fiocruz-FIO00422
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
MSBNK-Fiocruz-FIO00423
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
MSBNK-Fiocruz-FIO00424
Catalpol
1 spectrum
C15H22O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
362.12131
LC-ESI-ITTOF; MS; [M+NH3+H]+
MSBNK-Univ_Toyama-TY000075
Catechin
39 spectra
C15H14O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
290.27100
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000403
LC-ESI-QTOF; MS
MSBNK-BS-BS003015
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302549
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302555
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302561
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302567
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302573
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302579
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302585
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302591
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302597
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302603
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302609
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR302615
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306208
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306214
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306220
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306226
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306232
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306238
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306244
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306250
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306256
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306262
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306268
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR306274
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309323
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311008
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB001329
LC-ESI-QTOF; MS2; CE:15 eV; [M-H]-
MSBNK-IPB_Halle-PB002429
LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
MSBNK-BS-BS003014
LC-ESI-QTOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB001330
LC-ESI-QTOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PB002430
LC-ESI-QTOF; MS2; CE:26 eV; [M-H]-
MSBNK-BS-BS003016
LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
MSBNK-IPB_Halle-PB001331
LC-ESI-QTOF; MS2; CE:40 eV; [M-H]-
MSBNK-IPB_Halle-PB002431
LC-ESI-QTOF; MS2; CE:55 eV; [M+H]+
MSBNK-IPB_Halle-PB001332
LC-ESI-QTOF; MS2; CE:55 eV; [M-H]-
MSBNK-IPB_Halle-PB002432
LC-ESI-QTOF; MS; CE:10 eV; [M-H]-
MSBNK-BS-BS003013
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