| SpectraBase Spectrum ID |
1bVpQfpKTJR |
| Name |
Glutaric acid, 2-ethylhexyl dec-4-enyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.308309828 u |
| Formula |
C23H42O4 |
| InChI |
InChI=1S/C23H42O4/c1-4-7-9-10-11-12-13-14-19-26-22(24)17-15-18-23(25)27-20-21(6-3)16-8-5-2/h11-12,21H,4-10,13-20H2,1-3H3/b12-11+ |
| InChIKey |
SFXYSKAUWGCNDW-VAWYXSNFSA-N |
| Molecular Weight |
382.585 g/mol |
| SMILES |
C(CCC(OCC(CC)CCCC)=O)C(OCCC\C=C\CCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.883147 |
