| SpectraBase Compound ID | 6OumOajEQrM |
|---|---|
| InChI | InChI=1S/C13H16F3NO/c1-3-4-8-17(2)12(18)10-6-5-7-11(9-10)13(14,15)16/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey | VFUPRZXSAODQPY-UHFFFAOYSA-N |
| Mol Weight | 259.27 g/mol |
| Molecular Formula | C13H16F3NO |
| Exact Mass | 259.118399 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H2nROLsIsy |
|---|---|
| Name | Benzamide, 3-trifluoromethyl-N-methyl-N-butyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.118398627 u |
| Formula | C13H16F3NO |
| InChI | InChI=1S/C13H16F3NO/c1-3-4-8-17(2)12(18)10-6-5-7-11(9-10)13(14,15)16/h5-7,9H,3-4,8H2,1-2H3 |
| InChIKey | VFUPRZXSAODQPY-UHFFFAOYSA-N |
| Molecular Weight | 259.272 g/mol |
| SMILES | C1=C(C=CC=C1C(F)(F)F)C(N(C)CCCC)=O |