| SpectraBase Spectrum ID |
2Uz8og8DThW |
| Name |
4-(4-Benzoxyphenyl)coumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.109944372 u |
| Formula |
C22H16O3 |
| InChI |
InChI=1S/C22H16O3/c23-22-14-20(19-8-4-5-9-21(19)25-22)17-10-12-18(13-11-17)24-15-16-6-2-1-3-7-16/h1-14H,15H2 |
| InChIKey |
VWDGEGYESZIPBL-UHFFFAOYSA-N |
| Molecular Weight |
328.367 g/mol |
| SMILES |
C=1(C=2C(=CC=CC2)OC(C1)=O)C=1C=CC(OCC=2C=CC=CC2)=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896936 |
