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

*Links on SpectraBase are not permalinks.

(Z)-2-METHYLPROPANETHIAL-S-OXIDE

Compound with spectra: 4 NMR

(Z)-2-METHYLPROPANETHIAL-S-OXIDE
SpectraBase Compound ID 8K1cg4qHRvD
InChI InChI=1S/C4H8OS/c1-4(2)3-6-5/h3-4H,1-2H3
InChIKey CMSLSBOATYSKKZ-UHFFFAOYSA-N
Mol Weight 104.17 g/mol
Molecular Formula C4H8OS
Exact Mass 104.029586 g/mol

View Spectrum of (Z)-2-METHYLPROPANETHIAL-S-OXIDE

17O NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of (Z)-2-METHYLPROPANETHIAL-S-OXIDE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.

View Spectrum of (Z)-2-METHYLPROPANETHIAL-S-OXIDE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of (Z)-2-METHYLPROPANETHIAL-S-OXIDE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • CMSLSBOATYSKKZ-UHFFFAOYSA-N
  • (E)-2-METHYLPROPANETHIAL-S-OXIDE
KUGFGBASDDWLNF-UHFFFAOYSA-N
(E)-2,2-DIMETHYLPROPANETHIAL-S-OXIDE
Isobutyraldehyde
3-METHYLBUTEN-1
3-Methylbutadiensulfine
1-Buten-1-one, 3-methyl-
Butenol <3-methyl->
Isopentenol
IWOKCMBOJXYDEE-UHFFFAOYSA-N
cis-4-Methyl-2-pentene
Title Journal or Book Year
Allium Chemistry:  Microwave Spectroscopic Identification, Mechanism of Formation, Synthesis, and Reactions of (E,Z)-Propanethial S-Oxide, the Lachrymatory Factor of the Onion (Allium cepa) Journal of the American Chemical Society 1996

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.

Other Resources
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.