| SpectraBase Compound ID | 8RG42So7O55 |
|---|---|
| InChI | InChI=1S/C22H42/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3 |
| InChIKey | ZWDGLNIBFWCFLJ-UHFFFAOYSA-N |
| Mol Weight | 306.6 g/mol |
| Molecular Formula | C22H42 |
| Exact Mass | 306.328651 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DLznr0gXeaj |
|---|---|
| Name | 11-Docosyne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.328651352 u |
| Formula | C22H42 |
| InChI | InChI=1S/C22H42/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3 |
| InChIKey | ZWDGLNIBFWCFLJ-UHFFFAOYSA-N |
| Molecular Weight | 306.578 g/mol |
| SMILES | C(#CCCCCCCCCCC)CCCCCCCCCC |