| SpectraBase Compound ID | FmmgCBC4B1N |
|---|---|
| InChI | InChI=1S/C28H55NO/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-28(30)29(26-6-3)27-24-8-5-2/h6H,3-5,7-27H2,1-2H3 |
| InChIKey | NHECLHJZNUDZKT-UHFFFAOYSA-N |
| Mol Weight | 421.8 g/mol |
| Molecular Formula | C28H55NO |
| Exact Mass | 421.428365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7tq4jgjLhgN |
|---|---|
| Name | Eicosanoylamide, N-allyl-N-pentyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 421.428365394 u |
| Formula | C28H55NO |
| InChI | InChI=1S/C28H55NO/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-28(30)29(26-6-3)27-24-8-5-2/h6H,3-5,7-27H2,1-2H3 |
| InChIKey | NHECLHJZNUDZKT-UHFFFAOYSA-N |
| Molecular Weight | 421.754 g/mol |
| SMILES | C(N(CCCCC)CC=C)(=O)CCCCCCCCCCCCCCCCCCC |