| SpectraBase Compound ID | 8utU0VJK9if |
|---|---|
| InChI | InChI=1S/C20H39NO2/c1-20(2)18-23-19(21-20)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-22/h22H,3-18H2,1-2H3 |
| InChIKey | QQXDQTXGKIQUFP-UHFFFAOYSA-N |
| Mol Weight | 325.5 g/mol |
| Molecular Formula | C20H39NO2 |
| Exact Mass | 325.298079 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KFkXwyXF7wK |
|---|---|
| Name | 16-Hydroxy-hexadecanoic acid, dmox derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.298079498 u |
| Formula | C20H39NO2 |
| InChI | InChI=1S/C20H39NO2/c1-20(2)18-23-19(21-20)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-22/h22H,3-18H2,1-2H3 |
| InChIKey | QQXDQTXGKIQUFP-UHFFFAOYSA-N |
| Molecular Weight | 325.537 g/mol |
| SMILES | C1(=NC(C)(C)CO1)CCCCCCCCCCCCCCCO |