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(E)-1-(Methylthio-methylene)-5,5-dimethyl-cyclopentanone
SpectraBase Compound ID IIhTkvyF29z
InChI InChI=1S/C9H14OS/c1-9(2)5-4-7(6-11-3)8(9)10/h6H,4-5H2,1-3H3/b7-6+
InChIKey DHJYVDYOPUOEAB-VOTSOKGWSA-N
Mol Weight 170.27 g/mol
Molecular Formula C9H14OS
Exact Mass 170.076536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7OT1Kx1AlZ4
Name (E)-1-(Methylthio-methylene)-5,5-dimethyl-cyclopentanone
CAS Registry Number 96899-02-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14OS
InChI InChI=1S/C9H14OS/c1-9(2)5-4-7(6-11-3)8(9)10/h6H,4-5H2,1-3H3/b7-6+
InChIKey DHJYVDYOPUOEAB-VOTSOKGWSA-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