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(2S,3R)-2-Phenyl-3-phenoxymethyl-1-(4-toluenesulfonyl)aziridine
SpectraBase Compound ID 1Qucc9HWzU8
InChI InChI=1S/C22H21NO3S/c1-17-12-14-20(15-13-17)27(24,25)23-21(16-26-19-10-6-3-7-11-19)22(23)18-8-4-2-5-9-18/h2-15,21-22H,16H2,1H3/t21-,22-,23?/m0/s1
InChIKey KYKLGDLWFVOEEV-OJSMNCEXSA-N
Mol Weight 379.47 g/mol
Molecular Formula C22H21NO3S
Exact Mass 379.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JDCFOcrwm
Name (2S,3R)-2-Phenyl-3-phenoxymethyl-1-(4-toluenesulfonyl)aziridine
Alternate Name(s) (2R,3S)-1-[(4-methylphenyl)sulfonyl]-2-(phenoxymethyl)-3-phenylaziridine {(2R,3S)-1-[(4-methylphenyl)sulfonyl]-3-phenylaziridinyl}methyl phenyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO3S
InChI InChI=1S/C22H21NO3S/c1-17-12-14-20(15-13-17)27(24,25)23-21(16-26-19-10-6-3-7-11-19)22(23)18-8-4-2-5-9-18/h2-15,21-22H,16H2,1H3/t21-,22-,23?/m0/s1
InChIKey KYKLGDLWFVOEEV-OJSMNCEXSA-N
Molecular Weight 379.474 g/mol
SMILES [C@@]1(N([C@]1(COc1ccccc1)[H])S(=O)(=O)c1ccc(cc1)C)(c1ccccc1)[H]
SPLASH splash10-0089-0960000000-00ff65a96a5a93f1c34b
Source of Spectrum KD-16-3731-16
Wiley ID 1638017