| SpectraBase Compound ID | 8iiXPrw751k |
|---|---|
| InChI | InChI=1S/C20H33NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-21-20(2,3)18-22-19/h6-7,9-10,12-13H,4-5,8,11,14-18H2,1-3H3/b7-6-,10-9-,13-12- |
| InChIKey | QJXIWGJGBRGSPK-QNEBEIHSSA-N |
| Mol Weight | 303.5 g/mol |
| Molecular Formula | C20H33NO |
| Exact Mass | 303.256215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9DBfLL18SXN |
|---|---|
| Name | 6,9,12-Hexadecatrienoic acid, dmox derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.256214686 u |
| Formula | C20H33NO |
| InChI | InChI=1S/C20H33NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-21-20(2,3)18-22-19/h6-7,9-10,12-13H,4-5,8,11,14-18H2,1-3H3/b7-6-,10-9-,13-12- |
| InChIKey | QJXIWGJGBRGSPK-QNEBEIHSSA-N |
| SMILES | C1(=NC(C)(C)CO1)CCCC\C=C/C\C=C/C\C=C/CCC |