| SpectraBase Compound ID | 45R2sg9Dd5Y |
|---|---|
| InChI | InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h8-11H,3-7,12-18H2,1-2H3/b9-8-,11-10- |
| InChIKey | KVIWYYOMPLJRMC-XESWYYRISA-N |
| Mol Weight | 294.5 g/mol |
| Molecular Formula | C19H34O2 |
| Exact Mass | 294.25588 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ATfbEkivde4 |
|---|---|
| Name | Octadeca-(9Z,11Z)-dienoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.255880333 u |
| Formula | C19H34O2 |
| InChI | InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h8-11H,3-7,12-18H2,1-2H3/b9-8-,11-10- |
| InChIKey | KVIWYYOMPLJRMC-XESWYYRISA-N |
| SMILES | C(CCCCCCC\C=C/C=C\CCCCCC)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972019 |