| SpectraBase Compound ID | GaDChpuMGAm |
|---|---|
| InChI | InChI=1S/C21H36F7NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-17-29(16-4-2)18(30)19(22,23)20(24,25)21(26,27)28/h3-17H2,1-2H3 |
| InChIKey | VDXCGVZGXAPZJA-UHFFFAOYSA-N |
| Mol Weight | 451.5 g/mol |
| Molecular Formula | C21H36F7NO |
| Exact Mass | 451.268512 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fi2pfwIHu4l |
|---|---|
| Name | Heptafluorobutyramide, N-propyl-N-tetradecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 451.268511923 u |
| Formula | C21H36F7NO |
| InChI | InChI=1S/C21H36F7NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-17-29(16-4-2)18(30)19(22,23)20(24,25)21(26,27)28/h3-17H2,1-2H3 |
| InChIKey | VDXCGVZGXAPZJA-UHFFFAOYSA-N |
| Molecular Weight | 451.514 g/mol |
| SMILES | C(N(CCCCCCCCCCCCCC)CCC)(=O)C(C(C(F)(F)F)(F)F)(F)F |