| SpectraBase Spectrum ID |
zr933LqOEJ |
| Name |
(2-Acetyl-3-benzoyloxy-phenyl) benzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
360.099773610 u |
| Formula |
C22H16O5 |
| InChI |
InChI=1S/C22H16O5/c1-15(23)20-18(26-21(24)16-9-4-2-5-10-16)13-8-14-19(20)27-22(25)17-11-6-3-7-12-17/h2-14H,1H3 |
| InChIKey |
QYFZYFIBENTTAX-UHFFFAOYSA-N |
| Molecular Weight |
360.365 g/mol |
| SMILES |
C(C)(=O)C=1C(=CC=CC1OC(C=1C=CC=CC1)=O)OC(C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949513 |
