| SpectraBase Spectrum ID |
BjO4f0c53F0 |
| Name |
Glutaric acid, 3-methylbut-2-en-1-yl 2-methoxyphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.146723803 u |
| Formula |
C17H22O5 |
| InChI |
InChI=1S/C17H22O5/c1-13(2)11-12-21-16(18)9-6-10-17(19)22-15-8-5-4-7-14(15)20-3/h4-5,7-8,11H,6,9-10,12H2,1-3H3 |
| InChIKey |
XXLAEWQJZUKYIX-UHFFFAOYSA-N |
| Molecular Weight |
306.358 g/mol |
| SMILES |
C(CCC(OCC=C(C)C)=O)C(OC1=CC=CC=C1OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826344 |
