| SpectraBase Spectrum ID |
GZwsqqtr89R |
| Name |
Ethyleneglycol dipelargonate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.277009700 u |
| Formula |
C20H38O4 |
| InChI |
InChI=1S/C20H38O4/c1-3-5-7-9-11-13-15-19(21)23-17-18-24-20(22)16-14-12-10-8-6-4-2/h3-18H2,1-2H3 |
| InChIKey |
OWRBDRUXEQZCIB-UHFFFAOYSA-N |
| Molecular Weight |
342.520 g/mol |
| SMILES |
CCCCCCCCC(OCCOC(CCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956901 |
