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CASMI_2016
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622 Hit.
( 187 - 218 Displayed )
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Name
Formula / Structure
ExactMass
ID
Benzophenone-3
1 spectrum
C14H12O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
228.07864
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM862902
Benzophenone-4
3 spectra
C14H12O6S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
308.03546
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM880203
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM822051
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM880251
Benzothiazole
1 spectrum
C7H5NS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
135.01427
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM882102
Benzotriazole
1 spectrum
C6H5N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
119.04835
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM879903
Benzyl butyl phthalate
1 spectrum
C19H20O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
312.13617
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM836901
Benzylamine
1 spectrum
C7H9N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
107.07350
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM808401
Benzylidenacetone
1 spectrum
C10H10O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
146.07317
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM817401
Bethamethasone
1 spectrum
C22H29FO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
392.19989
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM874301
Bezafibrate
2 spectra
C19H20ClNO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
361.10809
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM854802
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM854852
Bicalutamide
1 spectrum
C18H14F4N2O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
430.06104
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM861551
Bifenox free acid
1 spectrum
C13H7Cl2NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
326.97012
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM845351
Bifonazol
1 spectrum
C22H18N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
310.14700
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM849101
Bis(2-ethylhexyl)phosphate
2 spectra
C16H35O4P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
322.22729
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM883301
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM883355
Bisoprolol
1 spectrum
C18H31NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
325.22531
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM859501
Bisphenol S
2 spectra
C12H10O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
250.02998
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM864401
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM864456
Boscalid
1 spectrum
C18H12Cl2N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
342.03268
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM843603
Bosentan
2 spectra
C27H29N5O6S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
551.18384
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM851503
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM851552
Bromochlorophen
1 spectrum
C13H8Br2Cl2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
423.82681
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM864952
Bromoxynil
1 spectrum
C7H3Br2NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
274.85815
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM844052
Bupirimate
1 spectrum
C13H24N4O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
316.15692
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM845402
Bupropion
1 spectrum
C13H18ClNO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
239.10770
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM859601
Butylamine
1 spectrum
C4H11N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
73.08915
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM817603
Butylparaben
1 spectrum
C11H14O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.09428
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM863955
Caffeine
1 spectrum
C8H10N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.08038
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM866601
Candesartan
2 spectra
C24H20N6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
440.15970
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM818201
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM818251
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