| SpectraBase Spectrum ID |
2qPUlznaxah |
| Name |
4-(2-Benzoyloxy-5-methyl-phenoxy)benzoic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.115423675 u |
| Formula |
C22H18O5 |
| InChI |
InChI=1S/C22H18O5/c1-15-8-13-19(27-22(24)16-6-4-3-5-7-16)20(14-15)26-18-11-9-17(10-12-18)21(23)25-2/h3-14H,1-2H3 |
| InChIKey |
CKZHWJSMCUSQFH-UHFFFAOYSA-N |
| Molecular Weight |
362.381 g/mol |
| SMILES |
C(OC=1C(OC2=CC=C(C(=O)OC)C=C2)=CC(=CC1)C)(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964192 |
