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1-(4-Methylphenyl)sulfonyl-5-[(phenylmethyl)amino]indole-4,7-dione
SpectraBase Compound ID poprn6Sblz
InChI InChI=1S/C22H18N2O4S/c1-15-7-9-17(10-8-15)29(27,28)24-12-11-18-21(24)20(25)13-19(22(18)26)23-14-16-5-3-2-4-6-16/h2-13,23H,14H2,1H3
InChIKey LXEAPFBWZPYRJY-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 5L9cYbWwT4O
Name 1-(4-Methylphenyl)sulfonyl-5-[(phenylmethyl)amino]indole-4,7-dione
Alternate Name(s) 5-(benzylamino)-1-(4-methylphenyl)sulfonylindole-4,7-dione 5-(benzylamino)-1-(p-tolylsulfonyl)indole-4,7-dione 5-(benzylamino)-1-tosyl-indole-4,7-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N2O4S
InChI InChI=1S/C22H18N2O4S/c1-15-7-9-17(10-8-15)29(27,28)24-12-11-18-21(24)20(25)13-19(22(18)26)23-14-16-5-3-2-4-6-16/h2-13,23H,14H2,1H3
InChIKey LXEAPFBWZPYRJY-UHFFFAOYSA-N
Molecular Weight 406.456 g/mol
SMILES N(C1=CC(c2[n](S(c3ccc(cc3)C)(=O)=O)ccc2C1=O)=O)Cc1ccccc1
SPLASH splash10-0udi-0293000000-5c6c3878deb437ba08d1
Source of Spectrum J-60-3545-15
Wiley ID 1372108