| SpectraBase Compound ID | P5mPaZmdzh |
|---|---|
| InChI | InChI=1S/C22H45NO/c1-5-7-8-9-10-11-12-13-14-15-16-17-19-23(18-6-2)22(24)20-21(3)4/h21H,5-20H2,1-4H3 |
| InChIKey | PFGGIYWFYMZCJL-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 | 8efOvYGmo1i |
|---|---|
| Name | Isovaleramide, N-propyl-N-tetradecyl- |
| 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/c1-5-7-8-9-10-11-12-13-14-15-16-17-19-23(18-6-2)22(24)20-21(3)4/h21H,5-20H2,1-4H3 |
| InChIKey | PFGGIYWFYMZCJL-UHFFFAOYSA-N |
| Molecular Weight | 339.608 g/mol |
| SMILES | C(N(CCC)CCCCCCCCCCCCCC)(=O)CC(C)C |