| SpectraBase Spectrum ID |
7RxjXlBeH7i |
| Name |
(9Z,11E)-Hexadeca-9,11-dienal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.214015521 u |
| Formula |
C16H28O |
| InChI |
InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-8,16H,2-4,9-15H2,1H3/b6-5+,8-7- |
| InChIKey |
YLYWMNJAJOQSGH-MDAAKZFYSA-N |
| Molecular Weight |
236.399 g/mol |
| SMILES |
C(\C=C\C=C/CCCCCCCC=O)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961739 |
