| SpectraBase Spectrum ID |
1hgHOX6z6F9 |
| Name |
1-Methoxy-4-(1-methylene-2-phenylsulfanyl-allyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
268.092186308 u |
| Formula |
C17H16OS |
| InChI |
InChI=1S/C17H16OS/c1-13(15-9-11-16(18-3)12-10-15)14(2)19-17-7-5-4-6-8-17/h4-12H,1-2H2,3H3 |
| InChIKey |
ZYOHYEBCMVXQBI-UHFFFAOYSA-N |
| Molecular Weight |
268.374 g/mol |
| SMILES |
C(C(C1=CC=C(C=C1)OC)=C)(SC=1C=CC=CC1)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938642 |
