| SpectraBase Compound ID | IwKE1wtWqoU |
|---|---|
| InChI | InChI=1S/C24H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(26)25-22-19-20-23-25/h7-8H,2-6,11-23H2,1H3/b8-7+ |
| InChIKey | GTJZUJHSXZUPES-BQYQJAHWSA-N |
| Mol Weight | 359.6 g/mol |
| Molecular Formula | C24H41NO |
| Exact Mass | 359.318815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8oGMgRoRqoa |
|---|---|
| Name | Eicosa-11-yn-13-trans-enoic acid, pyrrolidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 359.318814943 u |
| Formula | C24H41NO |
| InChI | InChI=1S/C24H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(26)25-22-19-20-23-25/h7-8H,2-6,11-23H2,1H3/b8-7+ |
| InChIKey | GTJZUJHSXZUPES-BQYQJAHWSA-N |
| Molecular Weight | 359.598 g/mol |
| SMILES | C(N1CCCC1)(CCCCCCCCCC#C\C=C\CCCCCC)=O |