| SpectraBase Spectrum ID |
1owXYQxQyWR |
| Name |
Glutaric acid, 3-methylbut-2-yl (2-naphthyl)methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.183109313 u |
| Formula |
C21H26O4 |
| InChI |
InChI=1S/C21H26O4/c1-15(2)16(3)25-21(23)10-6-9-20(22)24-14-17-11-12-18-7-4-5-8-19(18)13-17/h4-5,7-8,11-13,15-16H,6,9-10,14H2,1-3H3 |
| InChIKey |
LJRVOYBPZHUTAZ-UHFFFAOYSA-N |
| Molecular Weight |
342.435 g/mol |
| SMILES |
C(CCC(OC(C(C)C)C)=O)C(OCC1=CC2=C(C=CC=C2)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.866993 |
