| SpectraBase Compound ID | CBRQ2a1X9UF |
|---|---|
| InChI | InChI=1S/C17H24F3NO/c1-4-6-11-21(13(3)8-5-2)16(22)14-9-7-10-15(12-14)17(18,19)20/h7,9-10,12-13H,4-6,8,11H2,1-3H3 |
| InChIKey | LCSZEKFXOPRQTM-UHFFFAOYSA-N |
| Mol Weight | 315.38 g/mol |
| Molecular Formula | C17H24F3NO |
| Exact Mass | 315.180999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3oqMcDtEDlG |
|---|---|
| Name | Benzamide, 3-trifluoromethyl-N-(2-pentyl)-N-butyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.180998885 u |
| Formula | C17H24F3NO |
| InChI | InChI=1S/C17H24F3NO/c1-4-6-11-21(13(3)8-5-2)16(22)14-9-7-10-15(12-14)17(18,19)20/h7,9-10,12-13H,4-6,8,11H2,1-3H3 |
| InChIKey | LCSZEKFXOPRQTM-UHFFFAOYSA-N |
| Molecular Weight | 315.380 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C1=CC(C(F)(F)F)=CC=C1)CCC |