| SpectraBase Spectrum ID |
9kEx5c6xnK2 |
| Name |
Glutaric acid, butyl 3-(2-methoxyethyl)nonyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
372.287574383 u |
| Formula |
C21H40O5 |
| InChI |
InChI=1S/C21H40O5/c1-4-6-8-9-11-19(14-17-24-3)15-18-26-21(23)13-10-12-20(22)25-16-7-5-2/h19H,4-18H2,1-3H3 |
| InChIKey |
GICOISREFMAJCO-UHFFFAOYSA-N |
| Molecular Weight |
372.546 g/mol |
| SMILES |
CCCCOC(CCCC(OCCC(CCOC)CCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.835828 |
