![1-[4-(Trifluoromethyl)phenyl]heptan-1-ol](/api/spectrum/BXWt5NgzJD1/structure.png?h=300&w=458 "1-[4-(Trifluoromethyl)phenyl]heptan-1-ol")
| SpectraBase Compound ID | Kvqi5O1aZJx |
|---|---|
| InChI | InChI=1S/C14H19F3O/c1-2-3-4-5-6-13(18)11-7-9-12(10-8-11)14(15,16)17/h7-10,13,18H,2-6H2,1H3 |
| InChIKey | WMKZZNVUQLWTTR-UHFFFAOYSA-N |
| Mol Weight | 260.3 g/mol |
| Molecular Formula | C14H19F3O |
| Exact Mass | 260.1388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BXWt5NgzJD1 |
|---|---|
| Name | 1-[4-(Trifluoromethyl)phenyl]heptan-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.138799720 u |
| Formula | C14H19F3O |
| InChI | InChI=1S/C14H19F3O/c1-2-3-4-5-6-13(18)11-7-9-12(10-8-11)14(15,16)17/h7-10,13,18H,2-6H2,1H3 |
| InChIKey | WMKZZNVUQLWTTR-UHFFFAOYSA-N |
| Molecular Weight | 260.300 g/mol |
| SMILES | C=1C=C(C=CC1C(F)(F)F)C(O)CCCCCC |