| SpectraBase Compound ID | 1Sq9PAZ7lWr |
|---|---|
| InChI | InChI=1S/C12H13F4NO/c1-3-4-17(2)11(18)8-5-9(12(14,15)16)7-10(13)6-8/h5-7H,3-4H2,1-2H3 |
| InChIKey | QMMSPNLWEOZZDB-UHFFFAOYSA-N |
| Mol Weight | 263.24 g/mol |
| Molecular Formula | C12H13F4NO |
| Exact Mass | 263.093327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1aTiFFBDIzP |
|---|---|
| Name | Benzamide, 3-fluoro-5-trifluoromethyl-N-methyl-N-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.093326694 u |
| Formula | C12H13F4NO |
| InChI | InChI=1S/C12H13F4NO/c1-3-4-17(2)11(18)8-5-9(12(14,15)16)7-10(13)6-8/h5-7H,3-4H2,1-2H3 |
| InChIKey | QMMSPNLWEOZZDB-UHFFFAOYSA-N |
| Molecular Weight | 263.236 g/mol |
| SMILES | C1=C(C=C(C=C1F)C(N(C)CCC)=O)C(F)(F)F |