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3-Benzoylmethylene-4-phenyl-3H-1,2-dithiole

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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IvKHlvsylkp
Name 3-Benzoylmethylene-4-phenyl-3H-1,2-dithiole
CAS Registry Number 5368-02-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name Bruker HX-270
Literature Reference C.T. Pedersen, E.G. Frandsen, Org. Magn. Resonance 9, 546 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3