| SpectraBase Compound ID | HgGzynpLd4M |
|---|---|
| InChI | InChI=1S/C11H13F3O2/c1-16-9-4-2-8(3-5-9)10(15)6-7-11(12,13)14/h2-5,10,15H,6-7H2,1H3 |
| InChIKey | QWCWQRBWNWQFAQ-UHFFFAOYSA-N |
| Mol Weight | 234.22 g/mol |
| Molecular Formula | C11H13F3O2 |
| Exact Mass | 234.086764 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1GZNMRzhooF |
|---|---|
| Name | 4,4,4-Trifluoro-1-(4-methoxyphenyl)butan-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.086764146 u |
| Formula | C11H13F3O2 |
| InChI | InChI=1S/C11H13F3O2/c1-16-9-4-2-8(3-5-9)10(15)6-7-11(12,13)14/h2-5,10,15H,6-7H2,1H3 |
| InChIKey | QWCWQRBWNWQFAQ-UHFFFAOYSA-N |
| Molecular Weight | 234.218 g/mol |
| SMILES | C(CCC(F)(F)F)(O)C=1C=CC(=CC1)OC |