| SpectraBase Compound ID | D8L0E3rBcJf |
|---|---|
| InChI | InChI=1S/C21H41NO/c1-19(2)16-14-12-10-8-6-5-7-9-11-13-15-17-20-22-21(3,4)18-23-20/h19H,5-18H2,1-4H3 |
| InChIKey | PLDMLGXLZCGJGJ-UHFFFAOYSA-N |
| Mol Weight | 323.6 g/mol |
| Molecular Formula | C21H41NO |
| Exact Mass | 323.318815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2B4bxfn8Ag |
|---|---|
| Name | 15-Methyl-hexadecanoic acid, dmox derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.318814943 u |
| Formula | C21H41NO |
| InChI | InChI=1S/C21H41NO/c1-19(2)16-14-12-10-8-6-5-7-9-11-13-15-17-20-22-21(3,4)18-23-20/h19H,5-18H2,1-4H3 |
| InChIKey | PLDMLGXLZCGJGJ-UHFFFAOYSA-N |
| Molecular Weight | 323.565 g/mol |
| SMILES | C1(=NC(C)(C)CO1)CCCCCCCCCCCCCC(C)C |