SpectraBase Spectrum ID |
H0POG1mEYnx |
Name |
1,1-Difluoro-3-phenylsulfonyl-2-(phenylthio)propene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
326.024678298 u |
Formula |
C15H12F2O2S2 |
InChI |
InChI=1S/C15H12F2O2S2/c16-15(17)14(20-12-7-3-1-4-8-12)11-21(18,19)13-9-5-2-6-10-13/h1-10H,11H2 |
InChIKey |
MNHRFGWOWYKDTB-UHFFFAOYSA-N |
Molecular Weight |
326.376 g/mol |
SMILES |
C(S(=O)(=O)C=1C=CC=CC1)C(=C(F)F)SC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.884587 |