![1-Isobutyryl-4-[3-(trifluoromethyl)phenyl]piperazine](/api/spectrum/Hhp3YTtEyo3/structure.png?h=300&w=458 "1-Isobutyryl-4-[3-(trifluoromethyl)phenyl]piperazine")
| SpectraBase Compound ID | 9JDH4xtR6tn |
|---|---|
| InChI | InChI=1S/C15H19F3N2O/c1-11(2)14(21)20-8-6-19(7-9-20)13-5-3-4-12(10-13)15(16,17)18/h3-5,10-11H,6-9H2,1-2H3 |
| InChIKey | QQVOAMNHRLMQIZ-UHFFFAOYSA-N |
| Mol Weight | 300.33 g/mol |
| Molecular Formula | C15H19F3N2O |
| Exact Mass | 300.144948 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hhp3YTtEyo3 |
|---|---|
| Name | 1-Isobutyryl-4-[3-(trifluoromethyl)phenyl]piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.144947728 u |
| Formula | C15H19F3N2O |
| InChI | InChI=1S/C15H19F3N2O/c1-11(2)14(21)20-8-6-19(7-9-20)13-5-3-4-12(10-13)15(16,17)18/h3-5,10-11H,6-9H2,1-2H3 |
| InChIKey | QQVOAMNHRLMQIZ-UHFFFAOYSA-N |
| Molecular Weight | 300.325 g/mol |
| SMILES | C(C1=CC(N2CCN(CC2)C(=O)C(C)C)=CC=C1)(F)(F)F |