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N-[(2S)-(2-Bromophenyl)(4-trifluoromethylphenyl)methyl]-4-methylbenzenesulfonamide
SpectraBase Compound ID 6aFUvdXbx8Z
InChI InChI=1S/C21H17BrF3NO2S/c1-14-6-12-17(13-7-14)29(27,28)26-20(18-4-2-3-5-19(18)22)15-8-10-16(11-9-15)21(23,24)25/h2-13,20,26H,1H3/t20-/m0/s1
InChIKey NLAHOXQJHXHHEA-FQEVSTJZSA-N
Mol Weight 484.33 g/mol
Molecular Formula C21H17BrF3NO2S
Exact Mass 483.011547 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfdUdEIrqWO
Name N-[(2S)-(2-Bromophenyl)(4-trifluoromethylphenyl)methyl]-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17BrF3NO2S
InChI InChI=1S/C21H17BrF3NO2S/c1-14-6-12-17(13-7-14)29(27,28)26-20(18-4-2-3-5-19(18)22)15-8-10-16(11-9-15)21(23,24)25/h2-13,20,26H,1H3/t20-/m0/s1
InChIKey NLAHOXQJHXHHEA-FQEVSTJZSA-N
Literature Reference DOI 10.1021/jo300201g
Molecular Weight 484.331 g/mol
SMILES N([C@](c1c(Br)cccc1)(c1ccc(C(F)(F)F)cc1)[H])S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0036-7419000000-bd7bce64bf7b68a79707
Source of Spectrum J-77-2917-7g
Synonyms (S)-N-((2-bromophenyl)(4-(trifluoromethyl)phenyl)methyl)-4-methylbenzenesulfonamide
Wiley ID 1745079