SpectraBase Spectrum ID |
F2nI0ICVpY7 |
Name |
Glutaric acid, di(2-(2-methoxyethyl)hexyl) ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
416.313789131 u |
Formula |
C23H44O6 |
InChI |
InChI=1S/C23H44O6/c1-5-7-10-20(14-16-26-3)18-28-22(24)12-9-13-23(25)29-19-21(11-8-6-2)15-17-27-4/h20-21H,5-19H2,1-4H3 |
InChIKey |
WWGWOAJJOXWCCE-UHFFFAOYSA-N |
Molecular Weight |
416.599 g/mol |
SMILES |
COCCC(CCCC)COC(CCCC(OCC(CCCC)CCOC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.988452 |