| SpectraBase Compound ID | ICx9B3gGQBx |
|---|---|
| InChI | InChI=1S/C30H58O/c1-4-6-8-10-12-14-15-16-18-19-21-23-25-29(3)27-28-30(31)26-24-22-20-17-13-11-9-7-5-2/h29-31H,4-16,18-19,21-28H2,1-3H3 |
| InChIKey | DMLZURMWOHBKQU-UHFFFAOYSA-N |
| Mol Weight | 434.8 g/mol |
| Molecular Formula | C30H58O |
| Exact Mass | 434.448766 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1KtAfs0HQ2u |
|---|---|
| Name | 15-Methyl-7-nonacosyn-12-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 434.448766487 u |
| Formula | C30H58O |
| InChI | InChI=1S/C30H58O/c1-4-6-8-10-12-14-15-16-18-19-21-23-25-29(3)27-28-30(31)26-24-22-20-17-13-11-9-7-5-2/h29-31H,4-16,18-19,21-28H2,1-3H3 |
| InChIKey | DMLZURMWOHBKQU-UHFFFAOYSA-N |
| Molecular Weight | 434.793 g/mol |
| SMILES | CCCCCCC#CCCCC(CCC(CCCCCCCCCCCCCC)C)O |