| SpectraBase Spectrum ID |
5kugQy9L713 |
| Name |
8-Hydroxy-8-(3-octyloxiran-2-yl)octanoic acid, o,o'-bis-methyl |
| 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/c1-4-5-6-7-8-12-15-18-20(24-18)17(22-2)14-11-9-10-13-16-19(21)23-3/h17-18,20H,4-16H2,1-3H3 |
| InChIKey |
WRIQKCBGOBEGTR-UHFFFAOYSA-N |
| Molecular Weight |
342.520 g/mol |
| SMILES |
C(CCCCCCC(C1OC1CCCCCCCC)OC)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905441 |
