| SpectraBase Compound ID | BmjCmjEAcC3 |
|---|---|
| InChI | InChI=1S/C13H13F3O2/c1-12(2)6-5-9-3-4-10(7-11(9)18-12)17-8-13(14,15)16/h3-7H,8H2,1-2H3 |
| InChIKey | CCHNFGXWDIOIPI-UHFFFAOYSA-N |
| Mol Weight | 258.24 g/mol |
| Molecular Formula | C13H13F3O2 |
| Exact Mass | 258.086764 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3xjnvEcn2jo |
|---|---|
| Name | 2,2-Dimethyl-7-(2,2,2-trifluoroethoxy)-2H-chromene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.086764146 u |
| Formula | C13H13F3O2 |
| InChI | InChI=1S/C13H13F3O2/c1-12(2)6-5-9-3-4-10(7-11(9)18-12)17-8-13(14,15)16/h3-7H,8H2,1-2H3 |
| InChIKey | CCHNFGXWDIOIPI-UHFFFAOYSA-N |
| Molecular Weight | 258.240 g/mol |
| SMILES | C=12OC(C=CC2=CC=C(C1)OCC(F)(F)F)(C)C |