For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,3R)-2-Benzoyl-3-(4-methoxyphenyl)-1-(4-toluenesulfonyl)aziridine
SpectraBase Compound ID GPxvByPLgKx
InChI InChI=1S/C23H21NO4S/c1-16-8-14-20(15-9-16)29(26,27)24-21(17-10-12-19(28-2)13-11-17)22(24)23(25)18-6-4-3-5-7-18/h3-15,21-22H,1-2H3/t21-,22+,24?/m1/s1
InChIKey DLKBRNGATDHESO-BVQDOMOSSA-N
Mol Weight 407.48 g/mol
Molecular Formula C23H21NO4S
Exact Mass 407.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 666tkG1uvaC
Name (2S,3R)-2-Benzoyl-3-(4-methoxyphenyl)-1-(4-toluenesulfonyl)aziridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21NO4S
InChI InChI=1S/C23H21NO4S/c1-16-8-14-20(15-9-16)29(26,27)24-21(17-10-12-19(28-2)13-11-17)22(24)23(25)18-6-4-3-5-7-18/h3-15,21-22H,1-2H3/t21-,22+,24?/m1/s1
InChIKey DLKBRNGATDHESO-BVQDOMOSSA-N
Molecular Weight 407.484 g/mol
SMILES [C@]1(N([C@@]1(c1ccc(cc1)OC)[H])S(=O)(=O)c1ccc(cc1)C)(C(c1ccccc1)=O)[H]
SPLASH splash10-0udi-2290000000-ca86a34217b55bec1552
Source of Spectrum KD-16-3730-7
Synonyms {(2S,3R)-3-(4-methoxyphenyl)-1-[(4-methylphenyl)sulfonyl]aziridinyl}(phenyl)methanone
Wiley ID 1638028