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N-Benzyl-4-({4-[(4-fluorobenzyl)amino]phenyl}sulfonyl)-aniline
SpectraBase Compound ID LDCJVwoZxJH
InChI InChI=1S/C26H23FN2O2S/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 MUZHUMBBQKXWKV-UHFFFAOYSA-N
Mol Weight 446.54 g/mol
Molecular Formula C26H23FN2O2S
Exact Mass 446.146427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMsojfagl7B
Name N-Benzyl-4-({4-[(4-fluorobenzyl)amino]phenyl}sulfonyl)-aniline
Alternate Name(s) N-benzyl-4-((4-((4-fluorobenzyl)amino)phenyl)sulfonyl)aniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23FN2O2S
InChI InChI=1S/C26H23FN2O2S/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 MUZHUMBBQKXWKV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201100554
Molecular Weight 446.540 g/mol
SMILES N(c1ccc(S(c2ccc(NCc3ccc(cc3)F)cc2)(=O)=O)cc1)Cc1ccccc1
SPLASH splash10-052e-7710900000-3baac1a4306aa33eff9b
Source of Spectrum ASC-354-860-5c
Wiley ID 1762914