| SpectraBase Compound ID | Gy4UTb4VvF |
|---|---|
| InChI | InChI=1S/C16H22F3NO/c1-4-5-9-20(11-12(2)3)15(21)13-7-6-8-14(10-13)16(17,18)19/h6-8,10,12H,4-5,9,11H2,1-3H3 |
| InChIKey | BGXIOKAFQMACPW-UHFFFAOYSA-N |
| Mol Weight | 301.35 g/mol |
| Molecular Formula | C16H22F3NO |
| Exact Mass | 301.165349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 47R1lVz2Xq0 |
|---|---|
| Name | Benzamide, 3-trifluoromethyl-N-isobutyl-N-butyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.165348820 u |
| Formula | C16H22F3NO |
| InChI | InChI=1S/C16H22F3NO/c1-4-5-9-20(11-12(2)3)15(21)13-7-6-8-14(10-13)16(17,18)19/h6-8,10,12H,4-5,9,11H2,1-3H3 |
| InChIKey | BGXIOKAFQMACPW-UHFFFAOYSA-N |
| Molecular Weight | 301.353 g/mol |
| SMILES | C1=C(C=CC=C1C(F)(F)F)C(N(CC(C)C)CCCC)=O |