| SpectraBase Spectrum ID |
F0Mh1IUDJ8L |
| Name |
5-Phenyl-7-phenylsulfonyl-2-vinyl-2,3,3A,4,5,6-hexahydro-2,3-benzofuran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.128965739 u |
| Formula |
C22H22O3S |
| InChI |
InChI=1S/C22H22O3S/c1-2-19-14-18-13-17(16-9-5-3-6-10-16)15-21(22(18)25-19)26(23,24)20-11-7-4-8-12-20/h2-12,17-19H,1,13-15H2 |
| InChIKey |
DAKDCMAMSLGDLV-UHFFFAOYSA-N |
| Molecular Weight |
366.475 g/mol |
| SMILES |
C1(S(=O)(=O)C2=CC=CC=C2)=C2C(CC(O2)C=C)CC(C1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898667 |
