| SpectraBase Compound ID | 78Xbd0mWfIl |
|---|---|
| InChI | InChI=1S/C12H6Cl3FO2S/c13-9-5-11(15)12(6-10(9)14)19(17,18)8-3-1-7(16)2-4-8/h1-6H |
| InChIKey | RDTOYPIXZQLRAN-UHFFFAOYSA-N |
| Mol Weight | 339.6 g/mol |
| Molecular Formula | C12H6Cl3FO2S |
| Exact Mass | 337.913812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EtBUnIXQdkA |
|---|---|
| Name | p-Fluorophenyl 2,4,5-trichlorophenyl sulfone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.913811868 u |
| Formula | C12H6Cl3FO2S |
| InChI | InChI=1S/C12H6Cl3FO2S/c13-9-5-11(15)12(6-10(9)14)19(17,18)8-3-1-7(16)2-4-8/h1-6H |
| InChIKey | RDTOYPIXZQLRAN-UHFFFAOYSA-N |
| Molecular Weight | 339.595 g/mol |
| SMILES | C=1C(Cl)=C(Cl)C=C(C1Cl)S(C1=CC=C(C=C1)F)(=O)=O |