| SpectraBase Compound ID | L2KfMIlgqSO |
|---|---|
| InChI | InChI=1S/C22H45NO/c1-6-9-10-11-12-13-14-15-16-17-19-23(21(5)8-3)22(24)20(4)18-7-2/h20-21H,6-19H2,1-5H3 |
| InChIKey | KSHKIAOYEGTRQD-UHFFFAOYSA-N |
| Mol Weight | 339.6 g/mol |
| Molecular Formula | C22H45NO |
| Exact Mass | 339.350115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EEnJl7K8fWk |
|---|---|
| Name | Valeramide, 2-methyl-N-(2-butyl)-N-dodecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.350115072 u |
| Formula | C22H45NO |
| InChI | InChI=1S/C22H45NO/c1-6-9-10-11-12-13-14-15-16-17-19-23(21(5)8-3)22(24)20(4)18-7-2/h20-21H,6-19H2,1-5H3 |
| InChIKey | KSHKIAOYEGTRQD-UHFFFAOYSA-N |
| Molecular Weight | 339.608 g/mol |
| SMILES | C(N(CCCCCCCCCCCC)C(CC)C)(=O)C(C)CCC |