| SpectraBase Compound ID | INwK9k7wHYI |
|---|---|
| InChI | InChI=1S/C26H51NO/c1-25(2)21-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-22-26(28)27-23-19-20-24-27/h25H,3-24H2,1-2H3 |
| InChIKey | JONFFQOJUOEVDW-UHFFFAOYSA-N |
| Mol Weight | 393.7 g/mol |
| Molecular Formula | C26H51NO |
| Exact Mass | 393.397065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IiE3cDcjJzF |
|---|---|
| Name | 20-Methyl-heneicosanoic acid, pyrrolidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 393.397065265 u |
| Formula | C26H51NO |
| InChI | InChI=1S/C26H51NO/c1-25(2)21-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-22-26(28)27-23-19-20-24-27/h25H,3-24H2,1-2H3 |
| InChIKey | JONFFQOJUOEVDW-UHFFFAOYSA-N |
| Molecular Weight | 393.700 g/mol |
| SMILES | C1N(CCC1)C(CCCCCCCCCCCCCCCCCCC(C)C)=O |