| SpectraBase Spectrum ID |
KEiStYQU0Dw |
| Name |
Diethylmalonic acid, di(2-ethylhexyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.323959893 u |
| Formula |
C23H44O4 |
| InChI |
InChI=1S/C23H44O4/c1-7-13-15-19(9-3)17-26-21(24)23(11-5,12-6)22(25)27-18-20(10-4)16-14-8-2/h19-20H,7-18H2,1-6H3 |
| InChIKey |
YODPTQXQCQWQTN-UHFFFAOYSA-N |
| Molecular Weight |
384.601 g/mol |
| SMILES |
CCC(C(OCC(CC)CCCC)=O)(C(OCC(CC)CCCC)=O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.978951 |
