| SpectraBase Spectrum ID |
4oLThFTWw8L |
| Name |
Sebacic acid, di(2-ethylbutyl) 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/c1-5-19(6-2)17-25-21(23)15-13-11-9-10-12-14-16-22(24)26-18-20(7-3)8-4/h19-20H,5-18H2,1-4H3 |
| InChIKey |
UWNCDRPJANDCBA-UHFFFAOYSA-N |
| Molecular Weight |
370.574 g/mol |
| SMILES |
C(CCCCCC(OCC(CC)CC)=O)CCC(OCC(CC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.994912 |
