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

*Links on SpectraBase are not permalinks.
trans-2-Ethyl-4-methyl-1,3-dithiane
SpectraBase Compound ID D4RPyGOrXHH
InChI InChI=1S/C7H14S2/c1-3-7-8-5-4-6(2)9-7/h6-7H,3-5H2,1-2H3/t6-,7-/m0/s1
InChIKey DPYABELTAMYOKW-BQBZGAKWSA-N
Mol Weight 162.31 g/mol
Molecular Formula C7H14S2
Exact Mass 162.053693 g/mol
Enantiomer InChIKey DPYABELTAMYOKW-RNFRBKRXSA-N
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample E. L. Eliel, V. S. Rao, F. G. Riddell J. Amer. Chem. Soc. 98, 3583(1976)
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • trans-2-ETHYL-4-METHYL-m-DITHIANE
  • M-DITHIANE, 2-ETHYL-4-METHYL-, trans-,
Title Journal or Book Year
Carbon-13 nuclear magnetic resonance spectra of saturated heterocycles. 3. 1,3-Dithianes Journal of the American Chemical Society 1976

This compound is available in the following databases:

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.