For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N-(Cyclohexylidenemethyl)-thiocarbamic acid, S-methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(Cyclohexylidene<ethoxycarbonyl>methyl)-thiocarbamic acid, S-methyl ester
SpectraBase Compound ID Lh2DdZ8zWDu
InChI InChI=1S/C12H19NO3S/c1-3-16-11(14)10(13-12(15)17-2)9-7-5-4-6-8-9/h3-8H2,1-2H3,(H,13,15)
InChIKey CWKKGIPUSPJCAL-UHFFFAOYSA-N
Mol Weight 257.35 g/mol
Molecular Formula C12H19NO3S
Exact Mass 257.108565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GVBmZVaypGS
Name N-(Cyclohexylidenemethyl)-thiocarbamic acid, S-methyl ester
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H19NO3S
InChI InChI=1S/C12H19NO3S/c1-3-16-11(14)10(13-12(15)17-2)9-7-5-4-6-8-9/h3-8H2,1-2H3,(H,13,15)
InChIKey CWKKGIPUSPJCAL-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference C. Alvarez-Ibarra, M.M. Lopez-Ranz, J. Chem. Soc. Perkin I 1577 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3