SpectraBase Spectrum ID |
IgpdiddfnA5 |
Name |
Oleyl alcohol, trifluoroacetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
364.258914854 u |
Formula |
C20H35F3O2 |
InChI |
InChI=1S/C20H35F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-19(24)20(21,22)23/h9-10H,2-8,11-18H2,1H3/b10-9- |
InChIKey |
FLDNEOWDJOPXSX-KTKRTIGZSA-N |
Molecular Weight |
364.493 g/mol |
SMILES |
C(\C=C/CCCCCCCC)CCCCCCCOC(C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979054 |