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Name
Formula / Structure
ExactMass
ID
Carboline
7 spectra
C11H8N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
168.06870
LC-ESI-QFT; MS2; CE: 61.67%; R=35000; [M+H]+
MSBNK-UFZ-UA007601
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU288201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU288202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU288203
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU288204
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU288205
LC-ESI-QTOF; MS2; CE: Ramp 20-30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU288206
Carboline base + 4H, carboxylic acid
1 spectrum
C12H12N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
216.24001
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311097
Carboline metabolite (C26H26N2O8)
1 spectrum
C26H26N2O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
494.50000
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311101
Carboline metabolite (C26H28N2O10)
1 spectrum
C26H28N2O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
528.51398
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311102
Carboline metabolite (C26H28N2O9)
1 spectrum
C26H28N2O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
512.51501
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311105
Carboline metabolite (C26H30N2O10)
1 spectrum
C26H30N2O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
530.53003
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR311106
CARBON TETRABROMIDE
1 spectrum
CBr4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
327.67334
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP011283
CARBON TETRACHLORIDE
2 spectra
CCl4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
151.87541
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002339
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP007671
CARBON-DIOXIDE
1 spectrum
CO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
43.98983
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001576
CARBON-MONOXIDE
1 spectrum
CO
27.99491
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP001577
Carbonyl cyanide chlorophenylhydrazone
9 spectra
C9H5ClN4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
204.02028
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002380
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002378
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002379
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU067551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU067552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU067553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU067554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU067555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU067556
Carbophenothion
8 spectra
C11H16ClO2PS3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
341.97391
LC-ESI-QFT; MS2; CE: 120%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133307
LC-ESI-QFT; MS2; CE: 15%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133301
LC-ESI-QFT; MS2; CE: 150%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133308
LC-ESI-QFT; MS2; CE: 30%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133302
LC-ESI-QFT; MS2; CE: 45%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133303
LC-ESI-QFT; MS2; CE: 60%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133304
LC-ESI-QFT; MS2; CE: 75%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133305
LC-ESI-QFT; MS2; CE: 90%; R=17500; [M+H]+
MSBNK-Eawag-EQ01133306
Carbosulfan
7 spectra
C20H32N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
380.21341
LC-ESI-QFT; MS2; CE: 120%; R=17500; [M+H]+
MSBNK-Eawag-EQ01121407
LC-ESI-QFT; MS2; CE: 15%; R=17500; [M+H]+
MSBNK-Eawag-EQ01121401
LC-ESI-QFT; MS2; CE: 30%; R=17500; [M+H]+
MSBNK-Eawag-EQ01121402
LC-ESI-QFT; MS2; CE: 45%; R=17500; [M+H]+
MSBNK-Eawag-EQ01121403
LC-ESI-QFT; MS2; CE: 60%; R=17500; [M+H]+
MSBNK-Eawag-EQ01121404
LC-ESI-QFT; MS2; CE: 75%; R=17500; [M+H]+
MSBNK-Eawag-EQ01121405
LC-ESI-QFT; MS2; CE: 90%; R=17500; [M+H]+
MSBNK-Eawag-EQ01121406
Carboxin
6 spectra
C12H13NO2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
235.06670
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU045601
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU045602
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU045603
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU045604
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU045605
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU045606
Carboxy terbinafine
16 spectra
C21H23NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
321.17291
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL2311094443
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL2311094442
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL2311094453
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL2311094444
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL2311094445
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL2311094454
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL2311094451
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL2311094439
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL2311094452
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311094441
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311094446
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL2311094447
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL2311094450
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL2311094449
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL2311094448
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL2311094440
CARBROMAL
1 spectrum
C7H13BrN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
236.01604
CI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003159
Carbutamide
16 spectra
C11H17N3O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
271.09906
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA001594
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA001593
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA001592
LC-ESI-Q; MS; POS; 60 V, 75 V
MSBNK-Waters-WA001591
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU069801
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU069851
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU069802
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU069852
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU069803
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU069853
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU069804
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU069854
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU069805
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU069855
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU069806
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU069856
Carebastine
16 spectra
C32H37NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
499.27231
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111016749
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111016760
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111016754
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111016761
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111016750
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111016748
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111016762
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111016758
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111016757
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111016755
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111016756
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111016753
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111016751
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111016747
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111016759
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111016752
Carfentrazone-ethyl
6 spectra
C15H14Cl2F3N3O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
411.03641
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU058701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU058702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU058703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU058704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU058705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU058706
Cariporide mesylate
6 spectra
C12H17N3O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
283.09906
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002101
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002097
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002102
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002098
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002099
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002100
Carisoprodol
10 spectra
C12H24N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.17361
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ332701
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ332702
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ332703
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ332704
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ332705
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ332706
CARISOPRODOL
1 spectrum
C12H24N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.17361
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP003873
Carisoprodol
10 spectra
C12H24N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
260.17361
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA001590
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA001589
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA001588
LC-ESI-Q; MS; POS; 60 V, 90 V
MSBNK-Waters-WA001587
Carmine red
5 spectra
C22H20O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
492.39691
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00406
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00407
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00408
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00405
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000331
Carminic acid
12 spectra
C22H20O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
492.09039
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002144
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002146
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002148
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002143
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002145
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002147
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU136551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU136552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU136553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU136554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU136555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU136556
Carminomycin I
5 spectra
C26H27NO10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
513.50580
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00818
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00819
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00820
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00817
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000326
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