| SpectraBase Compound ID | 3SB8tj6PIxW |
|---|---|
| InChI | InChI=1S/C11H11F3N2O3/c12-11(13,14)10(19)16-8(9(15)18)5-6-1-3-7(17)4-2-6/h1-4,8,17H,5H2,(H2,15,18)(H,16,19) |
| InChIKey | CCWSJKCINIALIT-UHFFFAOYSA-N |
| Mol Weight | 276.22 g/mol |
| Molecular Formula | C11H11F3N2O3 |
| Exact Mass | 276.072177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DcyOB5wTqVk |
|---|---|
| Name | 3-(4-Hydroxy-phenyl)-2-(2,2,2-trifluoro-acetylamino)-propionamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.072176708 u |
| Formula | C11H11F3N2O3 |
| InChI | InChI=1S/C11H11F3N2O3/c12-11(13,14)10(19)16-8(9(15)18)5-6-1-3-7(17)4-2-6/h1-4,8,17H,5H2,(H2,15,18)(H,16,19) |
| InChIKey | CCWSJKCINIALIT-UHFFFAOYSA-N |
| Molecular Weight | 276.215 g/mol |
| SMILES | Oc1ccc(CC(C(N)=O)NC(C(F)(F)F)=O)cc1 |