| SpectraBase Spectrum ID |
8XSaAIuwFfm |
| Name |
3,3,3-Trifluoro-1,1-diphenyl-2-phenylsulfonylpropene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.074485384 u |
| Formula |
C21H15F3O2S |
| InChI |
InChI=1S/C21H15F3O2S/c22-21(23,24)20(27(25,26)18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15H |
| InChIKey |
RGIHGOJITLMSMP-UHFFFAOYSA-N |
| Molecular Weight |
388.404 g/mol |
| SMILES |
C(S(=O)(=O)C1=CC=CC=C1)(C(F)(F)F)=C(C1=CC=CC=C1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933418 |
