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N-Benzyl-4-({4-[(4-bromobenzyl)amino]phenyl}sulfonyl)-aniline
SpectraBase Compound ID CNio18vXT5Q
InChI InChI=1S/C26H23BrN2O2S/c27-22-8-6-21(7-9-22)19-29-24-12-16-26(17-13-24)32(30,31)25-14-10-23(11-15-25)28-18-20-4-2-1-3-5-20/h1-17,28-29H,18-19H2
InChIKey DFDJPMLENZEALC-UHFFFAOYSA-N
Mol Weight 507.45 g/mol
Molecular Formula C26H23BrN2O2S
Exact Mass 506.066362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExSBLzXqgrj
Name N-Benzyl-4-({4-[(4-bromobenzyl)amino]phenyl}sulfonyl)-aniline
Alternate Name(s) N-benzyl-4-((4-((4-bromobenzyl)amino)phenyl)sulfonyl)aniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23BrN2O2S
InChI InChI=1S/C26H23BrN2O2S/c27-22-8-6-21(7-9-22)19-29-24-12-16-26(17-13-24)32(30,31)25-14-10-23(11-15-25)28-18-20-4-2-1-3-5-20/h1-17,28-29H,18-19H2
InChIKey DFDJPMLENZEALC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201100554
Molecular Weight 507.446 g/mol
SMILES N(c1ccc(S(c2ccc(NCc3ccc(cc3)Br)cc2)(=O)=O)cc1)Cc1ccccc1
SPLASH splash10-002f-9010610000-e8391919f577f7cdcba5
Source of Spectrum ASC-354-860-5e
Wiley ID 1762916