| SpectraBase Compound ID | KwOaw1lqWT1 |
|---|---|
| InChI | InChI=1S/C26H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22-20-23-26(27)24-25/h4-7,20,22-24,27H,2-3,8-19,21H2,1H3/b5-4+,7-6+ |
| InChIKey | LMZCWUNDFQWEJA-YTXTXJHMSA-N |
| Mol Weight | 370.6 g/mol |
| Molecular Formula | C26H42O |
| Exact Mass | 370.323566 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JlggglmlQpv |
|---|---|
| Name | Phenol, 3-(icosa-14,16-dien-1-yl) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 370.323565971 u |
| Formula | C26H42O |
| InChI | InChI=1S/C26H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22-20-23-26(27)24-25/h4-7,20,22-24,27H,2-3,8-19,21H2,1H3/b5-4+,7-6+ |
| InChIKey | LMZCWUNDFQWEJA-YTXTXJHMSA-N |
| Molecular Weight | 370.621 g/mol |
| SMILES | C1(=CC(=CC=C1)CCCCCCCCCCCCC\C=C\C=C\CCC)O |