![1-(2-Chlorophenyl)-4-[2-(1-methyl-1H-pyrazol-4-yl)ethyl]piperazine](/api/spectrum/6LCYChsDmfK/structure.png?h=300&w=458 "1-(2-Chlorophenyl)-4-[2-(1-methyl-1H-pyrazol-4-yl)ethyl]piperazine")
| SpectraBase Compound ID | 8uDiT6BxUQs |
|---|---|
| InChI | InChI=1S/C16H21ClN4/c1-19-13-14(12-18-19)6-7-20-8-10-21(11-9-20)16-5-3-2-4-15(16)17/h2-5,12-13H,6-11H2,1H3 |
| InChIKey | WBFVWQJVMMIQFI-UHFFFAOYSA-N |
| Mol Weight | 304.83 g/mol |
| Molecular Formula | C16H21ClN4 |
| Exact Mass | 304.145474 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6LCYChsDmfK |
|---|---|
| Name | 1-(2-Chlorophenyl)-4-[2-(1-methyl-1H-pyrazol-4-yl)ethyl]piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.145474392 u |
| Formula | C16H21ClN4 |
| InChI | InChI=1S/C16H21ClN4/c1-19-13-14(12-18-19)6-7-20-8-10-21(11-9-20)16-5-3-2-4-15(16)17/h2-5,12-13H,6-11H2,1H3 |
| InChIKey | WBFVWQJVMMIQFI-UHFFFAOYSA-N |
| Molecular Weight | 304.825 g/mol |
| SMILES | C1(Cl)=C(N2CCN(CC2)CCC2=CN(C)N=C2)C=CC=C1 |