| SpectraBase Spectrum ID |
CwKXWl31ech |
| Name |
Succinic acid, decyl 2,4,4-trimethylpentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.308309828 u |
| Formula |
C22H42O4 |
| InChI |
InChI=1S/C22H42O4/c1-6-7-8-9-10-11-12-13-16-25-20(23)14-15-21(24)26-18-19(2)17-22(3,4)5/h19H,6-18H2,1-5H3 |
| InChIKey |
RBSSIPQTWWERMJ-UHFFFAOYSA-N |
| Molecular Weight |
370.574 g/mol |
| SMILES |
C(CCC(OCC(CC(C)(C)C)C)=O)(OCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913947 |
