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(2S,3R)-2-(4-Nitrobenzoyl)-3-phenyl-1-(4-toluenesulfonyl)aziridine
SpectraBase Compound ID 65Zcx6GBHp6
InChI InChI=1S/C22H18N2O5S/c1-15-7-13-19(14-8-15)30(28,29)23-20(16-5-3-2-4-6-16)21(23)22(25)17-9-11-18(12-10-17)24(26)27/h2-14,20-21H,1H3/t20-,21+,23?/m1/s1
InChIKey FBXWYLATKUXQFQ-VXVSGHKGSA-N
Mol Weight 422.46 g/mol
Molecular Formula C22H18N2O5S
Exact Mass 422.093643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K46krMIEwqp
Name (2S,3R)-2-(4-Nitrobenzoyl)-3-phenyl-1-(4-toluenesulfonyl)aziridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N2O5S
InChI InChI=1S/C22H18N2O5S/c1-15-7-13-19(14-8-15)30(28,29)23-20(16-5-3-2-4-6-16)21(23)22(25)17-9-11-18(12-10-17)24(26)27/h2-14,20-21H,1H3/t20-,21+,23?/m1/s1
InChIKey FBXWYLATKUXQFQ-VXVSGHKGSA-N
Molecular Weight 422.455 g/mol
SMILES [C@]1(N([C@@]1(c1ccccc1)[H])S(=O)(=O)c1ccc(cc1)C)(C(c1ccc(cc1)N(=O)=O)=O)[H]
SPLASH splash10-0udi-0910200000-c4d622e8a368aaec4856
Source of Spectrum KD-16-3731-7
Synonyms {(2S,3R)-1-[(4-methylphenyl)sulfonyl]-3-phenylaziridinyl}(4-nitrophenyl)methanone
Wiley ID 1638023