| SpectraBase Spectrum ID |
D5FwF5ERnqj |
| Name |
6-(2-Propenyl)-2-(phenylsulfonyl)-1,3-cyclohexadiene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.087100927 u |
| Formula |
C15H16O2S |
| InChI |
InChI=1S/C15H16O2S/c1-2-7-13-8-6-11-15(12-13)18(16,17)14-9-4-3-5-10-14/h2-6,9-13H,1,7-8H2 |
| InChIKey |
OSGNXTJXRQNHSS-UHFFFAOYSA-N |
| Molecular Weight |
260.351 g/mol |
| SMILES |
C1(S(=O)(=O)C2=CC=CC=C2)=CC(CC=C)CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896665 |
