| SpectraBase Compound ID | 7iyE5YFqeFX |
|---|---|
| InChI | InChI=1S/C21H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-22-21(2,3)19-23-20/h4-19H2,1-3H3 |
| InChIKey | SLFATBTVUKIGGG-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 | Ce2lBPLI04J |
|---|---|
| Name | Heptadecanoic 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/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-22-21(2,3)19-23-20/h4-19H2,1-3H3 |
| InChIKey | SLFATBTVUKIGGG-UHFFFAOYSA-N |
| Molecular Weight | 323.565 g/mol |
| SMILES | C1(=NC(C)(C)CO1)CCCCCCCCCCCCCCCC |