| SpectraBase Spectrum ID |
9YNxA9BchHT |
| Name |
(E)-3-Phenyl-1-propenyl vinyl sulfone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
208.055800798 u |
| Formula |
C11H12O2S |
| InChI |
InChI=1S/C11H12O2S/c1-2-14(12,13)10-6-9-11-7-4-3-5-8-11/h2-8,10H,1,9H2/b10-6+ |
| InChIKey |
OMIWJYWKASVHJK-UXBLZVDNSA-N |
| Molecular Weight |
208.275 g/mol |
| SMILES |
C(\C=C\S(C=C)(=O)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954613 |