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2-(2-Methyl-1-methylthio-butylidene)-cyclohexanone
SpectraBase Compound ID JZ2VeRZ9nRw
InChI InChI=1S/C12H20OS/c1-4-9(2)12(14-3)10-7-5-6-8-11(10)13/h9H,4-8H2,1-3H3/b12-10+
InChIKey LLIBFLDPRHKPIY-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 Dd3rMZcn4Gh
Name 2-(2-Methyl-1-methylthio-butylidene)-cyclohexanone
CAS Registry Number 96899-14-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20OS
InChI InChI=1S/C12H20OS/c1-4-9(2)12(14-3)10-7-5-6-8-11(10)13/h9H,4-8H2,1-3H3/b12-10+
InChIKey LLIBFLDPRHKPIY-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