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N-{[3'-Bromo-1'-(phenylsulfonyl)indol-2'-yl]methyl}-aniline
SpectraBase Compound ID 5UdS9RzL66G
InChI InChI=1S/C21H17BrN2O2S/c22-21-18-13-7-8-14-19(18)24(27(25,26)17-11-5-2-6-12-17)20(21)15-23-16-9-3-1-4-10-16/h1-14,23H,15H2
InChIKey AZBQFTLDSJNWMB-UHFFFAOYSA-N
Mol Weight 441.34 g/mol
Molecular Formula C21H17BrN2O2S
Exact Mass 440.019412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YdxsJxItsJ
Name N-{[3'-Bromo-1'-(phenylsulfonyl)indol-2'-yl]methyl}-aniline
Alternate Name(s) N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}-N-phenylamine N-{[3-bromo-1-(phenylsulfonyl)-1H-indol-2-yl]methyl}aniline
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Formula C21H17BrN2O2S
InChI InChI=1S/C21H17BrN2O2S/c22-21-18-13-7-8-14-19(18)24(27(25,26)17-11-5-2-6-12-17)20(21)15-23-16-9-3-1-4-10-16/h1-14,23H,15H2
InChIKey AZBQFTLDSJNWMB-UHFFFAOYSA-N
Molecular Weight 441.343 g/mol
SMILES N(Cc1[n](S(=O)(=O)c2ccccc2)c2c(cccc2)c1Br)c1ccccc1
SPLASH splash10-0ftg-4289700000-9db782063ddf31ef93ca
Source of Spectrum MZ-34-1330-5
Wiley ID 1582185