| SpectraBase Spectrum ID |
QFQICPiMZB |
| Name |
2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[4-(acetyloxy)phenyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.084517467 u |
| Formula |
C21H16O8 |
| InChI |
InChI=1S/C21H16O8/c1-11(22)26-15-6-4-14(5-7-15)17-10-20(25)29-19-9-16(27-12(2)23)8-18(21(17)19)28-13(3)24/h4-10H,1-3H3 |
| InChIKey |
ABPAECXMPXPVMR-UHFFFAOYSA-N |
| Molecular Weight |
396.351 g/mol |
| SMILES |
C=1(C=2C(=CC(=CC2OC(=O)C)OC(=O)C)OC(C1)=O)C1=CC=C(OC(=O)C)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853978 |
![2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[4-(acetyloxy)phenyl]-](/api/spectrum/QFQICPiMZB/structure.png?h=300&w=458 "2H-1-Benzopyran-2-one, 5,7-bis(acetyloxy)-4-[4-(acetyloxy)phenyl]-")
