| SpectraBase Compound ID | F8qhONJ5U5k |
|---|---|
| InChI | InChI=1S/C7H6Cl2O2S/c8-7-4-2-1-3-6(7)5-12(9,10)11/h1-4H,5H2 |
| InChIKey | CHPZYFXSICSCNY-UHFFFAOYSA-N |
| Mol Weight | 225.09 g/mol |
| Molecular Formula | C7H6Cl2O2S |
| Exact Mass | 223.946556 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 80bwPX9HAwI |
|---|---|
| Name | 2-Chlorobenzylsulfonyl chloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.946556005 u |
| Formula | C7H6Cl2O2S |
| InChI | InChI=1S/C7H6Cl2O2S/c8-7-4-2-1-3-6(7)5-12(9,10)11/h1-4H,5H2 |
| InChIKey | CHPZYFXSICSCNY-UHFFFAOYSA-N |
| Molecular Weight | 225.089 g/mol |
| SMILES | C1(Cl)=C(CS(=O)(=O)Cl)C=CC=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.937695 |