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(E)-2-(1-Methylthio-ethylidene)-4-phenyl-cyclohexanone
SpectraBase Compound ID CnIEW5mLDXL
InChI InChI=1S/C14H16OS/c1-16-10-13-9-12(7-8-14(13)15)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/b13-10+
InChIKey VPKAOJMJACNSNQ-JLHYYAGUSA-N
Mol Weight 232.34 g/mol
Molecular Formula C14H16OS
Exact Mass 232.092186 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AQtykmLpxf0
Name (E)-2-(1-Methylthio-ethylidene)-4-phenyl-cyclohexanone
CAS Registry Number 96899-48-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H16OS
InChI InChI=1S/C14H16OS/c1-16-10-13-9-12(7-8-14(13)15)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/b13-10+
InChIKey VPKAOJMJACNSNQ-JLHYYAGUSA-N
Instrument Name Jeol FX-90
Literature Reference R.K. Dieter, L.A. Silks, J.R. Fishpaugh, J. Am. Chem. Soc. 107, 4679 (1985).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3