| SpectraBase Compound ID | KjsjlHt48Of |
|---|---|
| InChI | InChI=1S/C16H13F3O3/c1-21-12-7-8-14(22-2)13(9-12)15(20)10-3-5-11(6-4-10)16(17,18)19/h3-9H,1-2H3 |
| InChIKey | ARONPFIHRSLSJT-UHFFFAOYSA-N |
| Mol Weight | 310.27 g/mol |
| Molecular Formula | C16H13F3O3 |
| Exact Mass | 310.081679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4PjINiY40dZ |
|---|---|
| Name | 2,5-Dimethoxyphenyl 4-(trifluoromethyl)phenyl methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.081678765 u |
| Formula | C16H13F3O3 |
| InChI | InChI=1S/C16H13F3O3/c1-21-12-7-8-14(22-2)13(9-12)15(20)10-3-5-11(6-4-10)16(17,18)19/h3-9H,1-2H3 |
| InChIKey | ARONPFIHRSLSJT-UHFFFAOYSA-N |
| Molecular Weight | 310.272 g/mol |
| SMILES | C=1(C(C=2C=CC(C(F)(F)F)=CC2)=O)C(=CC=C(C1)OC)OC |