| SpectraBase Spectrum ID |
7xwQXGXcqjd |
| Name |
Ethyl 5-benzoyloxy-2-ethoxy-4,6-dimethylbenzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.146723803 u |
| Formula |
C20H22O5 |
| InChI |
InChI=1S/C20H22O5/c1-5-23-16-12-13(3)18(14(4)17(16)20(22)24-6-2)25-19(21)15-10-8-7-9-11-15/h7-12H,5-6H2,1-4H3 |
| InChIKey |
RUYMRBVRBNDZCV-UHFFFAOYSA-N |
| Molecular Weight |
342.391 g/mol |
| SMILES |
C(C=1C(=CC(=C(C1C)OC(C=1C=CC=CC1)=O)C)OCC)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90976 |
