| SpectraBase Compound ID | GlRrQ5WqlUL |
|---|---|
| InChI | InChI=1S/C28H56O2/c1-4-27(3)25-23-21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24-26-28(29)30-5-2/h27H,4-26H2,1-3H3 |
| InChIKey | JMWDULDXZHGQIC-UHFFFAOYSA-N |
| Mol Weight | 424.8 g/mol |
| Molecular Formula | C28H56O2 |
| Exact Mass | 424.428031 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LtZPk0ngsVq |
|---|---|
| Name | Ethyl 23-methylpentacosanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 424.428031041 u |
| Formula | C28H56O2 |
| InChI | InChI=1S/C28H56O2/c1-4-27(3)25-23-21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24-26-28(29)30-5-2/h27H,4-26H2,1-3H3 |
| InChIKey | JMWDULDXZHGQIC-UHFFFAOYSA-N |
| Molecular Weight | 424.754 g/mol |
| SMILES | C(CCCCCCCCCCCCCCCCCCCCCC(CC)C)(=O)OCC |