![2,2,2-trifluoro-N-[(1S)-2-hydroxy-1-methyl-ethyl]acetamide](/api/spectrum/E5U0lqvUvbp/structure.png?h=300&w=458 "2,2,2-trifluoro-N-[(1S)-2-hydroxy-1-methyl-ethyl]acetamide")
| SpectraBase Compound ID | 4c60w23gubl |
|---|---|
| InChI | InChI=1S/C5H8F3NO2/c1-3(2-10)9-4(11)5(6,7)8/h3,10H,2H2,1H3,(H,9,11)/t3-/m0/s1 |
| InChIKey | FQZGFKHGAHLJBN-VKHMYHEASA-N |
| Mol Weight | 171.12 g/mol |
| Molecular Formula | C5H8F3NO2 |
| Exact Mass | 171.050713 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E5U0lqvUvbp |
|---|---|
| Name | 2,2,2-Trifluoro-N-[(1S)-2-hydroxy-1-methyl-ethyl]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.050712989 u |
| Formula | C5H8F3NO2 |
| InChI | InChI=1S/C5H8F3NO2/c1-3(2-10)9-4(11)5(6,7)8/h3,10H,2H2,1H3,(H,9,11)/t3-/m0/s1 |
| InChIKey | FQZGFKHGAHLJBN-VKHMYHEASA-N |
| Molecular Weight | 171.119 g/mol |
| SMILES | C(C(N[C@](CO)(C)[H])=O)(F)(F)F |