| SpectraBase Compound ID | FdkF1kUnsTp |
|---|---|
| InChI | InChI=1S/C7H7ClO2S/c8-6-11(9,10)7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | NXAIQSVCXQZNRY-UHFFFAOYSA-N |
| Mol Weight | 190.64 g/mol |
| Molecular Formula | C7H7ClO2S |
| Exact Mass | 189.985528 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 6z0bBFYt195 |
|---|---|
| Name | Chloromethyl phenyl sulfone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.985528337 u |
| Formula | C7H7ClO2S |
| InChI | InChI=1S/C7H7ClO2S/c8-6-11(9,10)7-4-2-1-3-5-7/h1-5H,6H2 |
| InChIKey | NXAIQSVCXQZNRY-UHFFFAOYSA-N |
| Molecular Weight | 190.644 g/mol |
| SMILES | C1(=CC=CC=C1)S(=O)(=O)CCl |
| Spectrum/Structure Validation Score (Raman) | 0.968511 |