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CASMI_2016
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622 Hit.
( 473 - 502 Displayed )
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Name
Formula / Structure
ExactMass
ID
Orlistat
1 spectrum
C29H53NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
495.39236
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM854101
Oryzalin
2 spectra
C12H18N4O6S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
346.09470
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM846503
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM846552
Oxadiazone
1 spectrum
C15H18Cl2N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
344.06946
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM846603
Oxazepam
2 spectra
C15H11ClN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.05090
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM860402
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM860452
Oxazol
1 spectrum
C3H3NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
69.02146
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM809305
Oxybenzone
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-SM814303
Oxybutynin
1 spectrum
C22H31NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
357.23038
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM849703
p-Toluenesulfonamide
1 spectrum
C7H9NO2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
171.03540
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM880502
Pantoprazole
2 spectra
C16H15F2N3O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
383.07513
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM833601
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM833651
Parathion-methyl
1 spectrum
C8H10NO5PS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
263.00174
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM848103
Paroxetine
1 spectrum
C19H20FNO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
329.14273
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM855502
Pendimethalin
1 spectrum
C13H19N3O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
281.13757
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM843503
Pentabromphenol
1 spectrum
C6HBr5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
483.59442
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM809453
Pentoxifylline
1 spectrum
C13H18N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
278.13788
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM861402
Perfluorobutanoic acid
1 spectrum
C4HF7O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
213.98648
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM823751
Perfluorodecanoic acid
1 spectrum
C10HF19O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
513.96735
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM876951
Perfluorohexanoic acid
1 spectrum
C6HF11O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
313.98010
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM877154
Perfluorooctanesulfonamide
1 spectrum
C8H2F17NO2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
498.95349
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM883551
Perfluorooctanesulfonic acid
1 spectrum
C8HF17O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
499.93750
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM877253
Perfluorooctanoic acid
1 spectrum
C8HF15O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
413.97369
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM877354
Pethoxamid
1 spectrum
C16H22ClNO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
295.13391
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM839902
Phenazine
1 spectrum
C12H8N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.06876
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM812904
Phenazone
1 spectrum
C11H12N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
188.09496
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM854601
Phenylbenzimidazole sulfonic acid
2 spectra
C13H10N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
274.04120
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM823802
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM823851
Phenylbenzimidazolesulfonic acid
2 spectra
C13H10N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
274.04120
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM878701
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM878751
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