| SpectraBase Compound ID | GhibsTLLKIW |
|---|---|
| InChI | InChI=1S/C25H49NO/c1-3-24(2)20-16-14-12-10-8-6-4-5-7-9-11-13-15-17-21-25(27)26-22-18-19-23-26/h24H,3-23H2,1-2H3 |
| InChIKey | ZISPNDGXXGACRS-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 | 2hl6Qp2LRKX |
|---|---|
| Name | 18-Methyl-eicosanoic 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/c1-3-24(2)20-16-14-12-10-8-6-4-5-7-9-11-13-15-17-21-25(27)26-22-18-19-23-26/h24H,3-23H2,1-2H3 |
| InChIKey | ZISPNDGXXGACRS-UHFFFAOYSA-N |
| Molecular Weight | 379.673 g/mol |
| SMILES | C1N(CCC1)C(CCCCCCCCCCCCCCCCC(CC)C)=O |