| SpectraBase Spectrum ID |
CjUjfbZRL3e |
| Name |
7-Pentyl-6-hexadecen-8-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.323565971 u |
| Formula |
C21H42O |
| InChI |
InChI=1S/C21H42O/c1-4-7-10-12-13-16-19-21(22)20(17-14-9-6-3)18-15-11-8-5-2/h18,21-22H,4-17,19H2,1-3H3/b20-18- |
| InChIKey |
MRXDEORBFHQTRV-ZZEZOPTASA-N |
| Molecular Weight |
310.566 g/mol |
| SMILES |
C(\C=C/(C(O)CCCCCCCC)CCCCC)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862628 |
