| SpectraBase Spectrum ID |
FXxJyPD3Gp |
| Name |
(E)-3-Hydroxy-3,7,11,15-tetramethyl-1-hexadecenyl acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.313395209 u |
| Formula |
C22H42O3 |
| InChI |
InChI=1S/C22H42O3/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-22(6,24)16-17-25-21(5)23/h16-20,24H,7-15H2,1-6H3/b17-16+ |
| InChIKey |
VPUJJMLLAZVZIC-WUKNDPDISA-N |
| Molecular Weight |
354.575 g/mol |
| SMILES |
C(O\C=C\C(O)(CCCC(CCCC(CCCC(C)C)C)C)C)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913022 |
