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Benzenesulfonic acid, 4-nitro-, 3,4'-dimethylbiphen-4-yl ester
SpectraBase Compound ID 10dUqbK8U1M
InChI InChI=1S/C20H17NO5S/c1-14-3-5-16(6-4-14)17-7-12-20(15(2)13-17)26-27(24,25)19-10-8-18(9-11-19)21(22)23/h3-13H,1-2H3
InChIKey DHYDPWBZYIWQST-UHFFFAOYSA-N
Mol Weight 383.42 g/mol
Molecular Formula C20H17NO5S
Exact Mass 383.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cv5IE9LRKfz
Name Benzenesulfonic acid, 4-nitro-, 3,4'-dimethylbiphen-4-yl ester
Alternate Name(s) 3,4'-Dimethyl[1,1'-biphenyl]-4-yl 4-nitrobenzenesulfonate 4-Nitrobenzenesulfonic acid [2-methyl-4-(4-methylphenyl)phenyl] ester [2-methyl-4-(p-tolyl)phenyl] 4-nitrobenzenesulfonate [2-methyl-4-(4-methylphenyl)phenyl] 4-nitrobenzenesulfonate
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Formula C20H17NO5S
InChI InChI=1S/C20H17NO5S/c1-14-3-5-16(6-4-14)17-7-12-20(15(2)13-17)26-27(24,25)19-10-8-18(9-11-19)21(22)23/h3-13H,1-2H3
InChIKey DHYDPWBZYIWQST-UHFFFAOYSA-N
Molecular Weight 383.418 g/mol
SMILES Cc1ccc(-c2ccc(OS(c3ccc(N(=O)=O)cc3)(=O)=O)c(c2)C)cc1
SPLASH splash10-0002-2901000000-1c594383c8ecd50e28d0
Wiley ID 1444189