| SpectraBase Compound ID | 9VigjLAmCNU |
|---|---|
| InChI | InChI=1S/C15H9F5N2O3/c16-14(17,15(18,19)20)13(23)21(10-4-2-1-3-5-10)11-6-8-12(9-7-11)22(24)25/h1-9H |
| InChIKey | KARAQNOGBMLLAU-UHFFFAOYSA-N |
| Mol Weight | 360.24 g/mol |
| Molecular Formula | C15H9F5N2O3 |
| Exact Mass | 360.053333 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LEimzElnvmH |
|---|---|
| Name | 2,2,3,3,3-Pentafluoro-N-(4-nitrophenyl)-N-phenylpropanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.053332970 u |
| Formula | C15H9F5N2O3 |
| InChI | InChI=1S/C15H9F5N2O3/c16-14(17,15(18,19)20)13(23)21(10-4-2-1-3-5-10)11-6-8-12(9-7-11)22(24)25/h1-9H |
| InChIKey | KARAQNOGBMLLAU-UHFFFAOYSA-N |
| Molecular Weight | 360.240 g/mol |
| SMILES | C1=CC=CC=C1N(C1=CC=C(C=C1)N(=O)=O)C(=O)C(C(F)(F)F)(F)F |