| SpectraBase Spectrum ID |
BLegiejLrXS |
| Name |
Sebacic acid, di(3-methylbut-2-enyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.245709571 u |
| Formula |
C20H34O4 |
| InChI |
InChI=1S/C20H34O4/c1-17(2)13-15-23-19(21)11-9-7-5-6-8-10-12-20(22)24-16-14-18(3)4/h13-14H,5-12,15-16H2,1-4H3 |
| InChIKey |
SBTCSFVKCOKYIX-UHFFFAOYSA-N |
| Molecular Weight |
338.488 g/mol |
| SMILES |
C(CCCCCCCCC(OCC=C(C)C)=O)(OCC=C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.992909 |
