| SpectraBase Spectrum ID |
1PG2QPzvSX |
| Name |
(R,E)-14-Methyl-8-hexadecenyl acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.271530397 u |
| Formula |
C19H36O2 |
| InChI |
InChI=1S/C19H36O2/c1-4-18(2)16-14-12-10-8-6-5-7-9-11-13-15-17-21-19(3)20/h6,8,18H,4-5,7,9-17H2,1-3H3/b8-6+/t18-/m1/s1 |
| InChIKey |
FUYDQBUNCMDNEI-JHTBKMLMSA-N |
| SMILES |
C(=O)(OCCCCCCC\C=C\CCCC[C@@](CC)(C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.890578 |
