| SpectraBase Compound ID | LomJfRU9Sm0 |
|---|---|
| InChI | InChI=1S/C22H40/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3,10,12,17,19H,1,4-9,11,13-16,18,20-22H2,2H3/b12-10+,19-17+ |
| InChIKey | CEKKAJBAVDWPJJ-HPXJZJFFSA-N |
| Mol Weight | 304.6 g/mol |
| Molecular Formula | C22H40 |
| Exact Mass | 304.313001 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G9fOz3BSOa8 |
|---|---|
| Name | E,E-1,9,17-Docasatriene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.313001288 u |
| Formula | C22H40 |
| InChI | InChI=1S/C22H40/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3,10,12,17,19H,1,4-9,11,13-16,18,20-22H2,2H3/b12-10+,19-17+ |
| InChIKey | CEKKAJBAVDWPJJ-HPXJZJFFSA-N |
| Molecular Weight | 304.562 g/mol |
| SMILES | C=CCCCCCC\C=C\CCCCCC\C=C\CCCC |