| SpectraBase Compound ID | 7wvCN9o2uBq |
|---|---|
| InChI | InChI=1S/C22H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-21-18-16-19-22(23)20-21/h4-7,16,18-20,23H,2-3,8-15,17H2,1H3/b5-4+,7-6+ |
| InChIKey | BABLOBFNTDNVKU-YTXTXJHMSA-N |
| Mol Weight | 314.5 g/mol |
| Molecular Formula | C22H34O |
| Exact Mass | 314.260966 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lljy3EW3PWN |
|---|---|
| Name | 3-(Hexadeca-10,12-dien-1-yl)phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.260965714 u |
| Formula | C22H34O |
| InChI | InChI=1S/C22H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-21-18-16-19-22(23)20-21/h4-7,16,18-20,23H,2-3,8-15,17H2,1H3/b5-4+,7-6+ |
| InChIKey | BABLOBFNTDNVKU-YTXTXJHMSA-N |
| Molecular Weight | 314.513 g/mol |
| SMILES | C1(=CC(=CC=C1)CCCCCCCCC\C=C\C=C\CCC)O |