| SpectraBase Compound ID | 44tUki1t95V |
|---|---|
| InChI | InChI=1S/C20H39NO/c1-18(2)15-13-11-9-7-5-6-8-10-12-14-16-19-21-20(3,4)17-22-19/h18H,5-17H2,1-4H3 |
| InChIKey | FQAGQNGJVQRVPA-UHFFFAOYSA-N |
| Mol Weight | 309.5 g/mol |
| Molecular Formula | C20H39NO |
| Exact Mass | 309.303165 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EXDhfk4jO5m |
|---|---|
| Name | 14-Methyl-pentadecanoic acid, dmox derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.303164879 u |
| Formula | C20H39NO |
| InChI | InChI=1S/C20H39NO/c1-18(2)15-13-11-9-7-5-6-8-10-12-14-16-19-21-20(3,4)17-22-19/h18H,5-17H2,1-4H3 |
| InChIKey | FQAGQNGJVQRVPA-UHFFFAOYSA-N |
| Molecular Weight | 309.538 g/mol |
| SMILES | C1(=NC(C)(C)CO1)CCCCCCCCCCCCC(C)C |