| SpectraBase Compound ID | 89hexOHXWoA |
|---|---|
| InChI | InChI=1S/C31H64O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(32)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32H,3-30H2,1-2H3 |
| InChIKey | CLDFUWPQRCVRHQ-UHFFFAOYSA-N |
| Mol Weight | 452.9 g/mol |
| Molecular Formula | C31H64O |
| Exact Mass | 452.495717 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7l4jACae6Wy |
|---|---|
| Name | 16-Hentriacontanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 452.495716680 u |
| Formula | C31H64O |
| InChI | InChI=1S/C31H64O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(32)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32H,3-30H2,1-2H3 |
| InChIKey | CLDFUWPQRCVRHQ-UHFFFAOYSA-N |
| Molecular Weight | 452.852 g/mol |
| SMILES | CCCCCCCCCCCCCCCC(O)CCCCCCCCCCCCCCC |