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1-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)carbonyl]-4-(4-methoxyphenyl)piperazine
SpectraBase Compound ID 7NMQrbBXdFj
InChI InChI=1S/C23H26N4O2/c1-17-22(18(2)27(24-17)20-7-5-4-6-8-20)23(28)26-15-13-25(14-16-26)19-9-11-21(29-3)12-10-19/h4-12H,13-16H2,1-3H3
InChIKey IJEZCWZXHWNXKI-UHFFFAOYSA-N
Mol Weight 390.49 g/mol
Molecular Formula C23H26N4O2
Exact Mass 390.205576 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ckTvYUnqA6
Name 1-[(3,5-Dimethyl-1-phenyl-1H-pyrazol-4-yl)carbonyl]-4-(4-methoxyphenyl)piperazine
Comments Computed using HOSE algorithm
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Exact Mass 390.205576091 u
Formula C23H26N4O2
InChI InChI=1S/C23H26N4O2/c1-17-22(18(2)27(24-17)20-7-5-4-6-8-20)23(28)26-15-13-25(14-16-26)19-9-11-21(29-3)12-10-19/h4-12H,13-16H2,1-3H3
InChIKey IJEZCWZXHWNXKI-UHFFFAOYSA-N
Molecular Weight 390.487 g/mol
SMILES C1(=C(N(C=2C=CC=CC2)N=C1C)C)C(N1CCN(CC1)C1=CC=C(C=C1)OC)=O