| SpectraBase Spectrum ID |
Er9NjrflxDj |
| Name |
4H-1-Benzopyran-4-one, 3-(2,4-dimethoxybenzoyl)-2-(2,4-dimethoxyphenyl)-5,7-dihydroxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
478.126382279 u |
| Formula |
C26H22O9 |
| InChI |
InChI=1S/C26H22O9/c1-31-14-5-7-16(19(11-14)33-3)24(29)23-25(30)22-18(28)9-13(27)10-21(22)35-26(23)17-8-6-15(32-2)12-20(17)34-4/h5-12,27-28H,1-4H3 |
| InChIKey |
XEGYAQKXOAOPRD-UHFFFAOYSA-N |
| Molecular Weight |
478.453 g/mol |
| SMILES |
C1(=C(OC=2C(C1=O)=C(C=C(O)C2)O)C=1C(=CC(=CC1)OC)OC)C(C=1C(=CC(=CC1)OC)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950369 |
