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(E)-2-(1-Methylthio-pentylidene)-cyclohexanone
SpectraBase Compound ID 1pstLKh26k5
InChI InChI=1S/C12H20OS/c1-3-4-9-12(14-2)10-7-5-6-8-11(10)13/h3-9H2,1-2H3/b12-10+
InChIKey DQXGHXXLPFRUNX-ZRDIBKRKSA-N
Mol Weight 212.35 g/mol
Molecular Formula C12H20OS
Exact Mass 212.123486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2iHdI87QRJ
Name (E)-2-(1-Methylthio-pentylidene)-cyclohexanone
CAS Registry Number 96899-12-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20OS
InChI InChI=1S/C12H20OS/c1-3-4-9-12(14-2)10-7-5-6-8-11(10)13/h3-9H2,1-2H3/b12-10+
InChIKey DQXGHXXLPFRUNX-ZRDIBKRKSA-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