| SpectraBase Compound ID | AxtpCiJkzau |
|---|---|
| InChI | InChI=1S/C12H15F3O2/c1-2-3-8-16-9-10-4-6-11(7-5-10)17-12(13,14)15/h4-7H,2-3,8-9H2,1H3 |
| InChIKey | DOKVACUJBSOUJP-UHFFFAOYSA-N |
| Mol Weight | 248.25 g/mol |
| Molecular Formula | C12H15F3O2 |
| Exact Mass | 248.102414 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 71yHMDdn8TP |
|---|---|
| Name | 4-(Trifluoromethyl)benzyl alcohol, N-butyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.102414210 u |
| Formula | C12H15F3O2 |
| InChI | InChI=1S/C12H15F3O2/c1-2-3-8-16-9-10-4-6-11(7-5-10)17-12(13,14)15/h4-7H,2-3,8-9H2,1H3 |
| InChIKey | DOKVACUJBSOUJP-UHFFFAOYSA-N |
| Molecular Weight | 248.245 g/mol |
| SMILES | C1=CC(=CC=C1COCCCC)OC(F)(F)F |