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2-Cyclohexen-1-one, 2-[(2-chloro-1,2-diphenylethenyl)thio]-, (E)-
SpectraBase Compound ID L4qPEueTSAw
InChI InChI=1S/C20H17ClOS/c21-19(15-9-3-1-4-10-15)20(16-11-5-2-6-12-16)23-18-14-8-7-13-17(18)22/h1-6,9-12,14H,7-8,13H2/b20-19-
InChIKey GKRYTKFEIWGYRI-VXPUYCOJSA-N
Mol Weight 340.87 g/mol
Molecular Formula C20H17ClOS
Exact Mass 340.068864 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bCfcsj0OCg
Name 2-Cyclohexen-1-one, 2-[(2-chloro-1,2-diphenylethenyl)thio]-, (E)-
CAS Registry Number 121926-52-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17ClOS
InChI InChI=1S/C20H17ClOS/c21-19(15-9-3-1-4-10-15)20(16-11-5-2-6-12-16)23-18-14-8-7-13-17(18)22/h1-6,9-12,14H,7-8,13H2/b20-19-
InChIKey GKRYTKFEIWGYRI-VXPUYCOJSA-N
Molecular Weight 340.868 g/mol
SMILES C=1(S\C(=C\(c2ccccc2)Cl)c2ccccc2)C(=O)CCCC1
SPLASH splash10-052f-0209000000-794c520842296ddc4e51
Source of Spectrum I-67-379-16
Synonyms 2-{[(Z)-2-chloro-1,2-diphenylethenyl]sulfanyl}-2-cyclohexen-1-one E-2-(2'-chloro-1',2'-diphenylethenylthio)-2-cyclohexenone
Wiley ID 1335222