| SpectraBase Spectrum ID |
IliMnO2IqN6 |
| Name |
Glutaric acid, heptyl 2-(2-methoxyethyl)heptyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.303224447 u |
| Formula |
C22H42O5 |
| InChI |
InChI=1S/C22H42O5/c1-4-6-8-9-11-17-26-21(23)14-12-15-22(24)27-19-20(16-18-25-3)13-10-7-5-2/h20H,4-19H2,1-3H3 |
| InChIKey |
JRPDMHMCIHAGPQ-UHFFFAOYSA-N |
| Molecular Weight |
386.573 g/mol |
| SMILES |
CCCCCCCOC(CCCC(OCC(CCCCC)CCOC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.809133 |
