| SpectraBase Spectrum ID |
6WXG5ByqCr8 |
| Name |
7-Benzyloxy-3,6-bis(3-methylbut-2-enyl)coumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.203844759 u |
| Formula |
C26H28O3 |
| InChI |
InChI=1S/C26H28O3/c1-18(2)10-12-21-14-23-15-22(13-11-19(3)4)26(27)29-25(23)16-24(21)28-17-20-8-6-5-7-9-20/h5-11,14-16H,12-13,17H2,1-4H3 |
| InChIKey |
AJEAYMGREGMZBK-UHFFFAOYSA-N |
| Molecular Weight |
388.507 g/mol |
| SMILES |
C1(OC=2C=C(C(=CC2C=C1CC=C(C)C)CC=C(C)C)OCC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.874676 |
