| SpectraBase Compound ID | Brityw7z6Vf |
|---|---|
| InChI | InChI=1S/C25H49NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25(27)26-23-20-21-24-26/h2-24H2,1H3 |
| InChIKey | NVYOCQJDTCPZBO-UHFFFAOYSA-N |
| Mol Weight | 379.7 g/mol |
| Molecular Formula | C25H49NO |
| Exact Mass | 379.381415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KBMbpA6Rtt |
|---|---|
| Name | Heneicosanooic acid, pyrrolidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 379.381415201 u |
| Formula | C25H49NO |
| InChI | InChI=1S/C25H49NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25(27)26-23-20-21-24-26/h2-24H2,1H3 |
| InChIKey | NVYOCQJDTCPZBO-UHFFFAOYSA-N |
| Molecular Weight | 379.673 g/mol |
| SMILES | C(N1CCCC1)(CCCCCCCCCCCCCCCCCCCC)=O |