| SpectraBase Spectrum ID |
FqTj7uoICUm |
| Name |
Glutaric acid, ethyl 4-methoxyphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.115423675 u |
| Formula |
C14H18O5 |
| InChI |
InChI=1S/C14H18O5/c1-3-18-13(15)5-4-6-14(16)19-12-9-7-11(17-2)8-10-12/h7-10H,3-6H2,1-2H3 |
| InChIKey |
VIBJSROZXQUPDR-UHFFFAOYSA-N |
| Molecular Weight |
266.293 g/mol |
| SMILES |
COC1=CC=C(OC(=O)CCCC(OCC)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811579 |
