| SpectraBase Spectrum ID |
FtJkVWPCX27 |
| Name |
Glutaric acid, di(oct-1-en-3-yl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.261359635 u |
| Formula |
C21H36O4 |
| InChI |
InChI=1S/C21H36O4/c1-5-9-11-14-18(7-3)24-20(22)16-13-17-21(23)25-19(8-4)15-12-10-6-2/h7-8,18-19H,3-6,9-17H2,1-2H3 |
| InChIKey |
OIKCEYXOKVCELJ-UHFFFAOYSA-N |
| Molecular Weight |
352.515 g/mol |
| SMILES |
C(CCC(OC(C=C)CCCCC)=O)C(OC(C=C)CCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847409 |
