![1-Methyl-4-{4-[(2,2,2-trifluoroethoxy)methyl]benzoyl}piperazine](/api/spectrum/HBM1SRUEEd7/structure.png?h=300&w=458 "1-Methyl-4-{4-[(2,2,2-trifluoroethoxy)methyl]benzoyl}piperazine")
| SpectraBase Compound ID | 6vfYcyWfULG |
|---|---|
| InChI | InChI=1S/C15H19F3N2O2/c1-19-6-8-20(9-7-19)14(21)13-4-2-12(3-5-13)10-22-11-15(16,17)18/h2-5H,6-11H2,1H3 |
| InChIKey | CPMWWFDRQWXLNP-UHFFFAOYSA-N |
| Mol Weight | 316.32 g/mol |
| Molecular Formula | C15H19F3N2O2 |
| Exact Mass | 316.139862 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HBM1SRUEEd7 |
|---|---|
| Name | 1-Methyl-4-{4-[(2,2,2-trifluoroethoxy)methyl]benzoyl}piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.139862347 u |
| Formula | C15H19F3N2O2 |
| InChI | InChI=1S/C15H19F3N2O2/c1-19-6-8-20(9-7-19)14(21)13-4-2-12(3-5-13)10-22-11-15(16,17)18/h2-5H,6-11H2,1H3 |
| InChIKey | CPMWWFDRQWXLNP-UHFFFAOYSA-N |
| Molecular Weight | 316.324 g/mol |
| SMILES | C(N1CCN(CC1)C)(C=1C=CC(=CC1)COCC(F)(F)F)=O |