| SpectraBase Compound ID | Fe0rUuIZEhT |
|---|---|
| InChI | InChI=1S/C13H7F5N2O/c14-8-7(9(15)11(17)12(18)10(8)16)13(21)20-5-6-1-3-19-4-2-6/h1-4H,5H2,(H,20,21) |
| InChIKey | FBTGUJKTSWDXFD-UHFFFAOYSA-N |
| Mol Weight | 302.2 g/mol |
| Molecular Formula | C13H7F5N2O |
| Exact Mass | 302.047854 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JDNZmt92OxK |
|---|---|
| Name | 2,3,4,5,6-Pentafluoro-N-(4-pyridinylmethyl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.047853667 u |
| Formula | C13H7F5N2O |
| InChI | InChI=1S/C13H7F5N2O/c14-8-7(9(15)11(17)12(18)10(8)16)13(21)20-5-6-1-3-19-4-2-6/h1-4H,5H2,(H,20,21) |
| InChIKey | FBTGUJKTSWDXFD-UHFFFAOYSA-N |
| Molecular Weight | 302.204 g/mol |
| SMILES | N(C(C1=C(C(F)=C(C(=C1F)F)F)F)=O)CC1=CC=NC=C1 |