| SpectraBase Compound ID | Eo6yykjsQMC |
|---|---|
| InChI | InChI=1S/C32H63NO/c1-31(2)27-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-28-32(34)33-29-25-26-30-33/h31H,3-30H2,1-2H3 |
| InChIKey | XGEVFFPUJWKFLQ-UHFFFAOYSA-N |
| Mol Weight | 477.9 g/mol |
| Molecular Formula | C32H63NO |
| Exact Mass | 477.490966 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ffc8YBLMDkO |
|---|---|
| Name | 26-Methyl-heptacosanoic acid, pyrrolidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 477.490965652 u |
| Formula | C32H63NO |
| InChI | InChI=1S/C32H63NO/c1-31(2)27-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-28-32(34)33-29-25-26-30-33/h31H,3-30H2,1-2H3 |
| InChIKey | XGEVFFPUJWKFLQ-UHFFFAOYSA-N |
| Molecular Weight | 477.862 g/mol |
| SMILES | C(N1CCCC1)(CCCCCCCCCCCCCCCCCCCCCCCCC(C)C)=O |