| SpectraBase Compound ID | 1Q2DJQKpAox |
|---|---|
| InChI | InChI=1S/C16H11F4NO2/c17-13-8-6-12(7-9-13)14(22)21(15(23)16(18,19)20)10-11-4-2-1-3-5-11/h1-9H,10H2 |
| InChIKey | XRIZRKSYAUGHIY-UHFFFAOYSA-N |
| Mol Weight | 325.26 g/mol |
| Molecular Formula | C16H11F4NO2 |
| Exact Mass | 325.072591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JTAydDvW7fg |
|---|---|
| Name | N-Benzyl-4-fluorobenzamide, N-trifluoroacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.072591248 u |
| Formula | C16H11F4NO2 |
| InChI | InChI=1S/C16H11F4NO2/c17-13-8-6-12(7-9-13)14(22)21(15(23)16(18,19)20)10-11-4-2-1-3-5-11/h1-9H,10H2 |
| InChIKey | XRIZRKSYAUGHIY-UHFFFAOYSA-N |
| Molecular Weight | 325.263 g/mol |
| SMILES | C1(F)=CC=C(C=C1)C(=O)N(CC1=CC=CC=C1)C(C(F)(F)F)=O |