| SpectraBase Spectrum ID |
AWBQq7A5FZy |
| Name |
18-Methyl-eicosane-1,2-diol, isopropylidene derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.365430784 u |
| Formula |
C24H48O2 |
| InChI |
InChI=1S/C24H48O2/c1-5-22(2)19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-23-21-25-24(3,4)26-23/h22-23H,5-21H2,1-4H3 |
| InChIKey |
LBXBIYFMRZEBDL-UHFFFAOYSA-N |
| Molecular Weight |
368.646 g/mol |
| SMILES |
CCC(CCCCCCCCCCCCCCCC1COC(O1)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919834 |
