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(E)-2,6-Dimethyl-5-methylthio-oct-4-en-3-one
SpectraBase Compound ID GHWMS2EAKRJ
InChI InChI=1S/C11H20OS/c1-6-9(4)11(13-5)7-10(12)8(2)3/h7-9H,6H2,1-5H3/b11-7+
InChIKey KFPYTXTUWJESNZ-YRNVUSSQSA-N
Mol Weight 200.34 g/mol
Molecular Formula C11H20OS
Exact Mass 200.123486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CLGkB8TNln1
Name (E)-2,6-Dimethyl-5-methylthio-oct-4-en-3-one
CAS Registry Number 96899-29-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H20OS
InChI InChI=1S/C11H20OS/c1-6-9(4)11(13-5)7-10(12)8(2)3/h7-9H,6H2,1-5H3/b11-7+
InChIKey KFPYTXTUWJESNZ-YRNVUSSQSA-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