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3-Benzoylmethylene-4-phenyl-3H-1,2-dithiole
SpectraBase Compound ID 5TN9VaUK14b
InChI InChI=1S/C17H12OS2/c18-16(14-9-5-2-6-10-14)11-17-15(12-19-20-17)13-7-3-1-4-8-13/h1-12H/b17-11-
InChIKey RMFRMURBIGJKHI-BOPFTXTBSA-N
Mol Weight 296.4 g/mol
Molecular Formula C17H12OS2
Exact Mass 296.032957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ES8jrUuMJcy
Name Ethanone, 1-phenyl-2-(4-phenyl-3H-1,2-dithiol-3-ylidene)-
Alternate Name(s) (2Z)-1-Phenyl-2-(4-phenyl-3H-1,2-dithiol-3-ylidene)ethanone (2Z)-1-phenyl-2-(4-phenyl-1,2-dithiol-3-ylidene)ethanone (2Z)-1-phenyl-2-(4-phenyl-3-dithiolylidene)ethanone (2Z)-1-phenyl-2-(4-phenyldithiol-3-ylidene)ethanone Acetophenone, 2-(4-phenyl-3H-1,2-dithiol-3-ylidene)-
CAS Registry Number 5368-02-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12OS2
InChI InChI=1S/C17H12OS2/c18-16(14-9-5-2-6-10-14)11-17-15(12-19-20-17)13-7-3-1-4-8-13/h1-12H/b17-11-
InChIKey RMFRMURBIGJKHI-BOPFTXTBSA-N
Molecular Weight 296.402 g/mol
SMILES C(=O)(\C=C\1SSC=C1c1ccccc1)c1ccccc1
SPLASH splash10-0a6s-3890000000-0862d68925c28275a16a
Source of Spectrum S-26-1308-4
Wiley ID 1299072