| SpectraBase Compound ID | 9AsZCb7vlg9 |
|---|---|
| InChI | InChI=1S/C12H6Cl4O2S/c13-7-2-1-3-8(4-7)19(17,18)12-6-10(15)9(14)5-11(12)16/h1-6H |
| InChIKey | HANSBILWZWHANS-UHFFFAOYSA-N |
| Mol Weight | 356.1 g/mol |
| Molecular Formula | C12H6Cl4O2S |
| Exact Mass | 353.884261 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KC5RqvzzkEl |
|---|---|
| Name | m-Chlorophenyl 2,4,5-trichlorophenyl sulfone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.884261405 u |
| Formula | C12H6Cl4O2S |
| InChI | InChI=1S/C12H6Cl4O2S/c13-7-2-1-3-8(4-7)19(17,18)12-6-10(15)9(14)5-11(12)16/h1-6H |
| InChIKey | HANSBILWZWHANS-UHFFFAOYSA-N |
| Molecular Weight | 356.050 g/mol |
| SMILES | C=1C(Cl)=C(Cl)C=C(C1Cl)S(C1=CC=CC(=C1)Cl)(=O)=O |