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(2S,3R)-2-(4-Fluorobenzoyl)-3-phenyl-1-(4-toluenesulfonyl)aziridine
SpectraBase Compound ID 1NYlsuZUhxJ
InChI InChI=1S/C22H18FNO3S/c1-15-7-13-19(14-8-15)28(26,27)24-20(16-5-3-2-4-6-16)21(24)22(25)17-9-11-18(23)12-10-17/h2-14,20-21H,1H3/t20-,21+,24?/m1/s1
InChIKey UKUDPDSZTVWEFV-JBAPTLGWSA-N
Mol Weight 395.45 g/mol
Molecular Formula C22H18FNO3S
Exact Mass 395.099143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALhZZwjobyF
Name (2S,3R)-2-(4-Fluorobenzoyl)-3-phenyl-1-(4-toluenesulfonyl)aziridine
Alternate Name(s) (4-fluorophenyl){(2S,3R)-1-[(4-methylphenyl)sulfonyl]-3-phenylaziridinyl}methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18FNO3S
InChI InChI=1S/C22H18FNO3S/c1-15-7-13-19(14-8-15)28(26,27)24-20(16-5-3-2-4-6-16)21(24)22(25)17-9-11-18(23)12-10-17/h2-14,20-21H,1H3/t20-,21+,24?/m1/s1
InChIKey UKUDPDSZTVWEFV-JBAPTLGWSA-N
Molecular Weight 395.448 g/mol
SMILES [C@]1(N([C@@]1(c1ccccc1)[H])S(=O)(=O)c1ccc(cc1)C)(C(c1ccc(cc1)F)=O)[H]
SPLASH splash10-00do-0971000000-a369a17558113ec963ea
Source of Spectrum KD-16-3730-7
Wiley ID 1638026