| SpectraBase Compound ID | BShC4UiDGgR |
|---|---|
| InChI | InChI=1S/C16H20F3NO2/c1-3-8-13(14(21)12-9-6-5-7-10-12)20(11-4-2)15(22)16(17,18)19/h5-7,9-10,13H,3-4,8,11H2,1-2H3 |
| InChIKey | QXWOYEYYWINFSW-UHFFFAOYSA-N |
| Mol Weight | 315.34 g/mol |
| Molecular Formula | C16H20F3NO2 |
| Exact Mass | 315.144613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5NlnZoWI82O |
|---|---|
| Name | .alpha.-Propylaminopentiophenone, N-trifluoroacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.144613375 u |
| Formula | C16H20F3NO2 |
| InChI | InChI=1S/C16H20F3NO2/c1-3-8-13(14(21)12-9-6-5-7-10-12)20(11-4-2)15(22)16(17,18)19/h5-7,9-10,13H,3-4,8,11H2,1-2H3 |
| InChIKey | QXWOYEYYWINFSW-UHFFFAOYSA-N |
| Molecular Weight | 315.336 g/mol |
| SMILES | C(C(N(CCC)C(C(F)(F)F)=O)CCC)(=O)C1=CC=CC=C1 |