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S-Phenyl (-)-(2S,1'S)-1-(1-Phenylethyl)aziridine-2-carbothioate
SpectraBase Compound ID D85E2qHJjJR
InChI InChI=1S/C17H17NOS/c1-13(14-8-4-2-5-9-14)18-12-16(18)17(19)20-15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3/t13-,16-,18?/m0/s1
InChIKey MALHZIYFWVLNPY-VKCAHTQSSA-N
Mol Weight 283.39 g/mol
Molecular Formula C17H17NOS
Exact Mass 283.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49x8ZH5hdQu
Name S-Phenyl (-)-(2S,1'S)-1-(1-Phenylethyl)aziridine-2-carbothioate
Alternate Name(s) S-Phenyl (-)-(S)-1-Benzyl-2-methylaziridine-2-carbothioate S-phenyl (2S)-1-[(1S)-1-phenylethyl]-2-aziridinecarbothioate
CAS Registry Number 114950-95-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NOS
InChI InChI=1S/C17H17NOS/c1-13(14-8-4-2-5-9-14)18-12-16(18)17(19)20-15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3/t13-,16-,18?/m0/s1
InChIKey MALHZIYFWVLNPY-VKCAHTQSSA-N
Molecular Weight 283.389 g/mol
SMILES [C@]1(N(C1)[C@](c1ccccc1)(C)[H])(C(Sc1ccccc1)=O)[H]
SPLASH splash10-0a4i-0900000000-9562cbf85f1b13243ea6
Source of Spectrum H-70-1689-15
Wiley ID 1287029