| SpectraBase Compound ID | EqUgemu8etc |
|---|---|
| InChI | InChI=1S/C8H8Cl2O2S/c9-5-6-13(11,12)8-3-1-7(10)2-4-8/h1-4H,5-6H2 |
| InChIKey | KXQHTLXSDBXWNB-UHFFFAOYSA-N |
| Mol Weight | 239.12 g/mol |
| Molecular Formula | C8H8Cl2O2S |
| Exact Mass | 237.962206 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 9PF3AaNJOUI |
|---|---|
| Name | 2-Chloroethyl p-chlorophenyl sulfone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.962206070 u |
| Formula | C8H8Cl2O2S |
| InChI | InChI=1S/C8H8Cl2O2S/c9-5-6-13(11,12)8-3-1-7(10)2-4-8/h1-4H,5-6H2 |
| InChIKey | KXQHTLXSDBXWNB-UHFFFAOYSA-N |
| Molecular Weight | 239.116 g/mol |
| SMILES | C=1C(=CC=C(C1)Cl)S(=O)(=O)CCCl |
| Spectrum/Structure Validation Score (Raman) | 0.891919 |