| SpectraBase Compound ID | 5yGpURw3TRu |
|---|---|
| InChI | InChI=1S/C11H13F3O/c1-2-3-7-15-10-6-4-5-9(8-10)11(12,13)14/h4-6,8H,2-3,7H2,1H3 |
| InChIKey | YMQZCIZZQXIVCX-UHFFFAOYSA-N |
| Mol Weight | 218.22 g/mol |
| Molecular Formula | C11H13F3O |
| Exact Mass | 218.09185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BbQYsAlEzD5 |
|---|---|
| Name | 1-Butoxy-3-(trifluoromethyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.091849527 u |
| Formula | C11H13F3O |
| InChI | InChI=1S/C11H13F3O/c1-2-3-7-15-10-6-4-5-9(8-10)11(12,13)14/h4-6,8H,2-3,7H2,1H3 |
| InChIKey | YMQZCIZZQXIVCX-UHFFFAOYSA-N |
| Molecular Weight | 218.219 g/mol |
| SMILES | C(OC=1C=CC=C(C1)C(F)(F)F)CCC |