| SpectraBase Compound ID | F9UuUQ7Fg67 |
|---|---|
| InChI | InChI=1S/C11H9F3O3/c1-17-9-5-3-2-4-7(9)8(15)6-10(16)11(12,13)14/h2-5H,6H2,1H3 |
| InChIKey | MEKQEULAECFIOH-UHFFFAOYSA-N |
| Mol Weight | 246.19 g/mol |
| Molecular Formula | C11H9F3O3 |
| Exact Mass | 246.050379 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GvYVcB2EkL0 |
|---|---|
| Name | 4,4,4-Trifluoro-1-(2-methoxyphenyl)butane-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.050378636 u |
| Formula | C11H9F3O3 |
| InChI | InChI=1S/C11H9F3O3/c1-17-9-5-3-2-4-7(9)8(15)6-10(16)11(12,13)14/h2-5H,6H2,1H3 |
| InChIKey | MEKQEULAECFIOH-UHFFFAOYSA-N |
| Molecular Weight | 246.185 g/mol |
| SMILES | C(F)(F)(F)C(=O)CC(=O)C1=C(C=CC=C1)OC |