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1-(4-Methylphenyl)sulfonyl-6-[(phenylmethyl)amino]indole-4,7-dione
SpectraBase Compound ID IC2sNPLpJVg
InChI InChI=1S/C22H18N2O4S/c1-15-7-9-17(10-8-15)29(27,28)24-12-11-18-20(25)13-19(22(26)21(18)24)23-14-16-5-3-2-4-6-16/h2-13,23H,14H2,1H3
InChIKey OHHSNFROBHMARS-UHFFFAOYSA-N
Mol Weight 406.46 g/mol
Molecular Formula C22H18N2O4S
Exact Mass 406.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FiaPzmNd2
Name 1-(4-Methylphenyl)sulfonyl-6-[(phenylmethyl)amino]indole-4,7-dione
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Formula C22H18N2O4S
InChI InChI=1S/C22H18N2O4S/c1-15-7-9-17(10-8-15)29(27,28)24-12-11-18-20(25)13-19(22(26)21(18)24)23-14-16-5-3-2-4-6-16/h2-13,23H,14H2,1H3
InChIKey OHHSNFROBHMARS-UHFFFAOYSA-N
Molecular Weight 406.456 g/mol
SMILES N(C=1C(c2[n](S(c3ccc(cc3)C)(=O)=O)ccc2C(=O)C1)=O)Cc1ccccc1
SPLASH splash10-0fbi-0950000000-7725ba73ccaeedf53a82
Source of Spectrum J-60-3545-10
Synonyms 6-(benzylamino)-1-(4-methylphenyl)sulfonylindole-4,7-dione 6-(benzylamino)-1-(p-tolylsulfonyl)indole-4,7-dione 6-(benzylamino)-1-tosyl-indole-4,7-quinone
Wiley ID 1372109