| SpectraBase Compound ID | Cl2wjUi2GuI |
|---|---|
| InChI | InChI=1S/C16H21F4NO/c1-3-5-7-21(8-6-4-2)15(22)12-9-13(16(18,19)20)11-14(17)10-12/h9-11H,3-8H2,1-2H3 |
| InChIKey | UWADQAPBAOVGME-UHFFFAOYSA-N |
| Mol Weight | 319.34 g/mol |
| Molecular Formula | C16H21F4NO |
| Exact Mass | 319.155927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BTHssG2uKmj |
|---|---|
| Name | Benzamide, 3-fluoro-5-trifluoromethyl-N,N-dibutyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.155926951 u |
| Formula | C16H21F4NO |
| InChI | InChI=1S/C16H21F4NO/c1-3-5-7-21(8-6-4-2)15(22)12-9-13(16(18,19)20)11-14(17)10-12/h9-11H,3-8H2,1-2H3 |
| InChIKey | UWADQAPBAOVGME-UHFFFAOYSA-N |
| Molecular Weight | 319.344 g/mol |
| SMILES | C1=C(C=C(C=C1F)C(N(CCCC)CCCC)=O)C(F)(F)F |