| SpectraBase Spectrum ID |
Iym5G3pcZfB |
| Name |
Glutaric acid, 2-decyl octyl 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/c1-4-6-8-10-12-14-17-21(3)27-23(25)19-16-18-22(24)26-20-15-13-11-9-7-5-2/h21H,4-20H2,1-3H3 |
| InChIKey |
PJAJQFGQZUHGEU-UHFFFAOYSA-N |
| Molecular Weight |
384.601 g/mol |
| SMILES |
CC(OC(CCCC(OCCCCCCCC)=O)=O)CCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902268 |
