| SpectraBase Compound ID | EvMaFfdqQeS |
|---|---|
| InChI | InChI=1S/C12H8F3NO/c13-12(14,15)11(17)10-7-6-9(16-10)8-4-2-1-3-5-8/h1-7,16H |
| InChIKey | GUYVQSCARHBGSB-UHFFFAOYSA-N |
| Mol Weight | 239.2 g/mol |
| Molecular Formula | C12H8F3NO |
| Exact Mass | 239.055798 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ZBBG9VxDpF |
|---|---|
| Name | 2-Trifluoroacetyl-5-phenylpyrrol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.055798370 u |
| Formula | C12H8F3NO |
| InChI | InChI=1S/C12H8F3NO/c13-12(14,15)11(17)10-7-6-9(16-10)8-4-2-1-3-5-8/h1-7,16H |
| InChIKey | GUYVQSCARHBGSB-UHFFFAOYSA-N |
| Molecular Weight | 239.197 g/mol |
| SMILES | N1C(=CC=C1c1ccccc1)C(=O)C(F)(F)F |