SpectraBase Spectrum ID |
Y1sBrZxAki |
Name |
3,13-Octadecadien-1-ol, (E,Z)-; 3E,13Z-octadecadien-1-ol; E,Z-3,13-octadecandien-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
266.260965714 u |
Formula |
C18H34O |
InChI |
InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h5-6,15-16,19H,2-4,7-14,17-18H2,1H3/b6-5-,16-15+ |
InChIKey |
QBNCGBJHGBGHLS-IYUNJCAYSA-N |
Molecular Weight |
266.469 g/mol |
SMILES |
OCC\C=C\CCCCCCCC\C=C/CCCC |
Spectrum/Structure Validation Score (Raman) |
0.991385 |