SpectraBase Compound ID | CDwjaVidZzR |
---|---|
InChI | InChI=1S/C3H5ClO2S/c1-7(5,6)3-2-4/h2-3H,1H3/b3-2- |
InChIKey | YYPFNMXWKWZKSS-IHWYPQMZSA-N |
Mol Weight | 140.58 g/mol |
Molecular Formula | C3H5ClO2S |
Exact Mass | 139.969878 g/mol |
SpectraBase Spectrum ID | BUe8V1oqkVC |
---|---|
Name | (Z)-1-Chloro-2-(methylsulfonyl)ethylene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 139.969878273 u |
Formula | C3H5ClO2S |
InChI | InChI=1S/C3H5ClO2S/c1-7(5,6)3-2-4/h2-3H,1H3/b3-2- |
InChIKey | YYPFNMXWKWZKSS-IHWYPQMZSA-N |
SMILES | CS(\C=C/Cl)(=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920923 |