| SpectraBase Spectrum ID |
D9MHmZqA7pL |
| Name |
Succinic acid, 3,7-dimethyloct-6-en-1-yl pentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.245709571 u |
| Formula |
C19H34O4 |
| InChI |
InChI=1S/C19H34O4/c1-5-6-7-14-22-18(20)11-12-19(21)23-15-13-17(4)10-8-9-16(2)3/h9,17H,5-8,10-15H2,1-4H3 |
| InChIKey |
IEPHCLKVAUZRRE-UHFFFAOYSA-N |
| Molecular Weight |
326.477 g/mol |
| SMILES |
CC(C)=CCCC(C)CCOC(CCC(OCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974631 |
