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S-Phenyl (-)-(2S,1'S)-2-Methyl-1-(1-phenylethyl)aziridine-2-carbothioate
SpectraBase Compound ID 54yxWWNtMJA
InChI InChI=1S/C18H19NOS/c1-14(15-9-5-3-6-10-15)19-13-18(19,2)17(20)21-16-11-7-4-8-12-16/h3-12,14H,13H2,1-2H3/t14-,18-,19?/m0/s1
InChIKey TXQGFRNYRSFNST-ZWSMLAFMSA-N
Mol Weight 297.42 g/mol
Molecular Formula C18H19NOS
Exact Mass 297.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLnU4zGNpVZ
Name S-Phenyl (-)-(2S,1'S)-2-Methyl-1-(1-phenylethyl)aziridine-2-carbothioate
Alternate Name(s) S-phenyl (2S)-2-methyl-1-[(1S)-1-phenylethyl]-2-aziridinecarbothioate
CAS Registry Number 114950-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NOS
InChI InChI=1S/C18H19NOS/c1-14(15-9-5-3-6-10-15)19-13-18(19,2)17(20)21-16-11-7-4-8-12-16/h3-12,14H,13H2,1-2H3/t14-,18-,19?/m0/s1
InChIKey TXQGFRNYRSFNST-ZWSMLAFMSA-N
Molecular Weight 297.416 g/mol
SMILES [C@]1(N([C@](c2ccccc2)(C)[H])C1)(C(Sc1ccccc1)=O)C
SPLASH splash10-0a4i-0900000000-fbf9472bd515e9355cdc
Source of Spectrum H-70-1690-19
Wiley ID 1300204