| SpectraBase Spectrum ID |
7N6tabQ7VQB |
| Name |
6-Methoxy-2-(3-methoxyphenyl)-2-(phenylthio)-benzofuran-3(2H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.092580230 u |
| Formula |
C22H18O4S |
| InChI |
InChI=1S/C22H18O4S/c1-24-16-8-6-7-15(13-16)22(27-18-9-4-3-5-10-18)21(23)19-12-11-17(25-2)14-20(19)26-22/h3-14H,1-2H3 |
| InChIKey |
RMVFHIMSKADJLB-UHFFFAOYSA-N |
| Molecular Weight |
378.442 g/mol |
| SMILES |
C=1(SC2(C(=O)C3=CC=C(OC)C=C3O2)C2=CC(OC)=CC=C2)C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857019 |
