| SpectraBase Compound ID | 6LF8s06OhBS |
|---|---|
| InChI | InChI=1S/C4H7ClO2S/c1-4(5)3-8(2,6)7/h1,3H2,2H3 |
| InChIKey | VRLBQKIEXVQHPI-UHFFFAOYSA-N |
| Mol Weight | 154.61 g/mol |
| Molecular Formula | C4H7ClO2S |
| Exact Mass | 153.985528 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8QDIanYpkFH |
|---|---|
| Name | 2-Chloranyl-3-methylsulfonyl-prop-1-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 153.985528337 u |
| Formula | C4H7ClO2S |
| InChI | InChI=1S/C4H7ClO2S/c1-4(5)3-8(2,6)7/h1,3H2,2H3 |
| InChIKey | VRLBQKIEXVQHPI-UHFFFAOYSA-N |
| SMILES | C=C(CS(=O)(=O)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.921986 |