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(Z)-2-(1-Methylthio-ethylidene)-cyclopentanone
SpectraBase Compound ID BT5xtfEDCG9
InChI InChI=1S/C8H12OS/c1-6(10-2)7-4-3-5-8(7)9/h3-5H2,1-2H3/b7-6-
InChIKey HUYMBAVAPBLYGP-SREVYHEPSA-N
Mol Weight 156.24 g/mol
Molecular Formula C8H12OS
Exact Mass 156.060886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VjTOJg0GY
Name (Z)-2-(1-Methylthio-ethylidene)-cyclopentanone
CAS Registry Number 96899-06-8
Comments SHIFT OF 148.7 PPM REPORTED FOR C6 MUST BE IN ERROR
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12OS
InChI InChI=1S/C8H12OS/c1-6(10-2)7-4-3-5-8(7)9/h3-5H2,1-2H3/b7-6-
InChIKey HUYMBAVAPBLYGP-SREVYHEPSA-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