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CASMI_2016
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622 Hit.
( 26 - 63 Displayed )
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Name
Formula / Structure
ExactMass
ID
2,4-Dihydroxybenzophenone
2 spectra
C13H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
214.06299
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM833201
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM833251
2,4-Dinitrophenol
2 spectra
C6H4N2O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
184.01202
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM807051
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM882351
2,4-Toluene diisocyanate
1 spectrum
C9H6N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.04292
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM832302
2,6-Dichlorobenzamide
1 spectrum
C7H5Cl2NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
188.97482
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM842901
2,6-Dimethylpyridine
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-SM807301
2,6-Xylidine
2 spectra
C8H11N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
121.08915
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM809801
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM882401
2,7-Naphthalenedisulfonic acid
1 spectrum
C10H8O6S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
287.97620
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM867751
2-(2-(Chlorophenyl)amino)benzaldehyde
1 spectrum
C13H10ClNO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
231.04509
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM856602
2-(4-Morpholinyl)benzothiazole
1 spectrum
C11H12N2OS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
220.06703
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM884101
2-(Methylthio)benzothiazole
1 spectrum
C8H7NS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
181.00198
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM881701
2-Aminoanthracene
1 spectrum
C14H11N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
193.08916
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM800802
2-Aminobenzoic acid
1 spectrum
C7H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.04768
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM800901
2-Aminobiphenyl
1 spectrum
C12H11N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
169.08916
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM801001
2-Aminophenol
1 spectrum
C6H7NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
109.05276
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM801101
2-Aminopyridine
1 spectrum
C5H6N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
94.05310
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM801201
2-Benzothiazolesulfonic acid
4 spectra
C7H5NO3S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
214.97108
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM820101
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM882601
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM820151
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM882651
2-Benzyl-4-chlorophenol
1 spectrum
C13H11ClO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
218.04980
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM814053
2-Hydroxyanthraquinone
2 spectra
C14H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.04733
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM814453
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM828951
2-Hydroxyatrazine
2 spectra
C8H15N5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
197.12766
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM844101
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM844151
2-Hydroxybenzothiazole
1 spectrum
C7H5NOS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
151.00919
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM871201
2-Hydroxycarbamazepine
1 spectrum
C15H12N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.08987
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM858353
2-Isopropyl-6-methyl-pyrimidin-4-ol
2 spectra
C8H12N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.09496
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM820301
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM881401
2-Isopropylthioxanthone
2 spectra
C16H14OS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.07654
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM820403
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM880001
2-Mercaptobenzimidazole
1 spectrum
C7H6N2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
150.02518
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM820501
2-Mercaptobenzothiazole
4 spectra
C7H5NS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.98634
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM820603
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM878502
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM820653
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM878551
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