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4-Ethoxy-3-(methylimino)-4-phenyl-2-thietanethione
SpectraBase Compound ID 8Lno5nWsX6h
InChI InChI=1S/C12H13NOS2/c1-3-14-12(9-7-5-4-6-8-9)10(13-2)11(15)16-12/h4-8H,3H2,1-2H3/b13-10+
InChIKey UEZHIYFZLZQIID-JLHYYAGUSA-N
Mol Weight 251.36 g/mol
Molecular Formula C12H13NOS2
Exact Mass 251.043856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DzXQuG5Lkcg
Name 4-Ethoxy-3-(methylimino)-4-phenyl-2-thietanethione
Alternate Name(s) (3Z)-4-ethoxy-3-[(Z)-methylimino]-4-phenyl-2-thietanethione
CAS Registry Number 116928-02-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NOS2
InChI InChI=1S/C12H13NOS2/c1-3-14-12(9-7-5-4-6-8-9)10(13-2)11(15)16-12/h4-8H,3H2,1-2H3/b13-10+
InChIKey UEZHIYFZLZQIID-JLHYYAGUSA-N
Molecular Weight 251.362 g/mol
SMILES C1(SC(\C1=N\C)=S)(c1ccccc1)OCC
SPLASH splash10-0ab9-0910000000-e64a4a6e1e10007a3a6a
Source of Spectrum K-122-81-10
Wiley ID 1254360