| SpectraBase Compound ID | CWXNUpHChGF |
|---|---|
| InChI | InChI=1S/C14H17F4NO4/c1-21-10-8-12(23-6-4-15)11(22-2)7-9(10)3-5-19-13(20)14(16,17)18/h7-8H,3-6H2,1-2H3,(H,19,20) |
| InChIKey | OWQIWVUWSUNDTR-UHFFFAOYSA-N |
| Mol Weight | 339.29 g/mol |
| Molecular Formula | C14H17F4NO4 |
| Exact Mass | 339.109371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | sZsplzZXGn |
|---|---|
| Name | 2C-o-21 tfa |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.109370679 u |
| Formula | C14H17F4NO4 |
| InChI | InChI=1S/C14H17F4NO4/c1-21-10-8-12(23-6-4-15)11(22-2)7-9(10)3-5-19-13(20)14(16,17)18/h7-8H,3-6H2,1-2H3,(H,19,20) |
| InChIKey | OWQIWVUWSUNDTR-UHFFFAOYSA-N |
| Molecular Weight | 339.287 g/mol |
| SMILES | C=1(C(=CC(=C(C1)OC)OCCF)OC)CCNC(C(F)(F)F)=O |