| SpectraBase Spectrum ID |
4G9EZXx61ZM |
| Name |
p-Fluorophenyl 2,4,5-trichlorophenyl sulfone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| 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 |
| Spectrum/Structure Validation Score (Raman) |
0.90959 |
