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trans-(+/-)-2-Bromo-1-(4-chlorophenyl)-3-phenyl-3-(p-tosylamino)propan-1-one
SpectraBase Compound ID HQyeAgkX9Pj
InChI InChI=1S/C22H19BrClNO3S/c1-15-7-13-19(14-8-15)29(27,28)25-21(16-5-3-2-4-6-16)20(23)22(26)17-9-11-18(24)12-10-17/h2-14,20-21,25H,1H3/t20-,21+/m0/s1
InChIKey XYTBWGJRASGWBV-LEWJYISDSA-N
Mol Weight 492.82 g/mol
Molecular Formula C22H19BrClNO3S
Exact Mass 490.995755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfFREEG17WZ
Name trans-(+/-)-2-Bromo-1-(4-chlorophenyl)-3-phenyl-3-(p-tosylamino)propan-1-one
Alternate Name(s) N-((1R,2S)-2-bromo-3-(4-chlorophenyl)-3-oxo-1-phenylpropyl)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19BrClNO3S
InChI InChI=1S/C22H19BrClNO3S/c1-15-7-13-19(14-8-15)29(27,28)25-21(16-5-3-2-4-6-16)20(23)22(26)17-9-11-18(24)12-10-17/h2-14,20-21,25H,1H3/t20-,21+/m0/s1
InChIKey XYTBWGJRASGWBV-LEWJYISDSA-N
Literature Reference DOI 10.1002/cjoc.201100176
Molecular Weight 492.815 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@](c1ccccc1)([C@](Br)(C(=O)c1ccc(cc1)Cl)[H])[H]
SPLASH splash10-0006-5970100000-12c3651ca4d4c1365f1d
Source of Spectrum CJC-30-391/SM3-4a
Wiley ID 1772702