| SpectraBase Compound ID | 9IpL3SG7CJd |
|---|---|
| InChI | InChI=1S/C14H17F4NO/c1-9(2)4-5-19(3)13(20)10-6-11(14(16,17)18)8-12(15)7-10/h6-9H,4-5H2,1-3H3 |
| InChIKey | ZEALRRLWRJCLOY-UHFFFAOYSA-N |
| Mol Weight | 291.29 g/mol |
| Molecular Formula | C14H17F4NO |
| Exact Mass | 291.124627 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KfxHApjJbOr |
|---|---|
| Name | Benzamide, 3-fluoro-5-trifluoromethyl-N-methyl-N-(3-methylbutyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.124626822 u |
| Formula | C14H17F4NO |
| InChI | InChI=1S/C14H17F4NO/c1-9(2)4-5-19(3)13(20)10-6-11(14(16,17)18)8-12(15)7-10/h6-9H,4-5H2,1-3H3 |
| InChIKey | ZEALRRLWRJCLOY-UHFFFAOYSA-N |
| Molecular Weight | 291.290 g/mol |
| SMILES | C1=C(C=C(C=C1F)C(N(C)CCC(C)C)=O)C(F)(F)F |