SpectraBase Spectrum ID |
InPebewLofT |
Name |
Glutaric acid, di(dec-4-enyl) ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
408.323959893 u |
Formula |
C25H44O4 |
InChI |
InChI=1S/C25H44O4/c1-3-5-7-9-11-13-15-17-22-28-24(26)20-19-21-25(27)29-23-18-16-14-12-10-8-6-4-2/h11-14H,3-10,15-23H2,1-2H3/b13-11+,14-12+ |
InChIKey |
LNWAOYZWLMXTSW-PHEQNACWSA-N |
Molecular Weight |
408.623 g/mol |
SMILES |
C(CCC(OCCC\C=C\CCCCC)=O)C(OCCC\C=C\CCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959427 |