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

*Links on SpectraBase are not permalinks.
1-Cyano-2,3-epithiopropane
SpectraBase Compound ID 2SdzesYrB1l
InChI InChI=1S/C4H5NS/c5-2-1-4-3-6-4/h4H,1,3H2
InChIKey BKIZJNMVTRYGSW-UHFFFAOYSA-N
Mol Weight 99.15 g/mol
Molecular Formula C4H5NS
Exact Mass 99.01427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID EeVjctHESnz
Name 1-Cyano-2,3-epithiopropane
CAS Registry Number 58130-93-1
Classification Epithionitriles
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 99.014270339 u
Formula C4H5NS
InChI InChI=1S/C4H5NS/c5-2-1-4-3-6-4/h4H,1,3H2
InChIKey BKIZJNMVTRYGSW-UHFFFAOYSA-N
Molecular Weight 99.151 g/mol
Number of Peaks 16
SMILES C(CC1CS1)#N
SPLASH splash10-052b-9000000000-351ec1f3fa5d62a52b54
Source of Spectrum FF-18-149-149_6 (DOI: 10.1002/ffj.1163)
Synonyms 2-(thiiran-2-yl)acetonitrile 3,4-Epithiobutane nitrile 2-(2-Thiiranyl)acetonitrile 2-(thiiran-2-yl)ethanenitrile 3,4-Epithiobutanenitrile Thiiraneacetonitrile
Wiley ID 1775326