| SpectraBase Spectrum ID |
CSlcAVTLdbz |
| Name |
Eicosanoic acid, 2-hydroxyethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
356.329045274 u |
| Formula |
C22H44O3 |
| InChI |
InChI=1S/C22H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)25-21-20-23/h23H,2-21H2,1H3 |
| InChIKey |
LLLBQVRKHDZZOU-UHFFFAOYSA-N |
| Molecular Weight |
356.591 g/mol |
| SMILES |
C(CCC(OCCO)=O)CCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947757 |
