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3-(4-Chlorophenyl)-4-(4-methoxyphenyl)-1-methyl-5-phenyl-1H-pyrazole
SpectraBase Compound ID KhBAzI2HC3w
InChI InChI=1S/C23H19ClN2O/c1-26-23(18-6-4-3-5-7-18)21(16-10-14-20(27-2)15-11-16)22(25-26)17-8-12-19(24)13-9-17/h3-15H,1-2H3
InChIKey NAIUYLVKPVAMCT-UHFFFAOYSA-N
Mol Weight 374.87 g/mol
Molecular Formula C23H19ClN2O
Exact Mass 374.118591 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AdMYNIsOaNH
Name 3-(4-Chlorophenyl)-4-(4-methoxyphenyl)-1-methyl-5-phenyl-1H-pyrazole
Comments Computed using HOSE algorithm
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Exact Mass 374.118590939 u
Formula C23H19ClN2O
InChI InChI=1S/C23H19ClN2O/c1-26-23(18-6-4-3-5-7-18)21(16-10-14-20(27-2)15-11-16)22(25-26)17-8-12-19(24)13-9-17/h3-15H,1-2H3
InChIKey NAIUYLVKPVAMCT-UHFFFAOYSA-N
Molecular Weight 374.871 g/mol
SMILES C1(=NN(C(=C1C1=CC=C(C=C1)OC)C1=CC=CC=C1)C)C1=CC=C(C=C1)Cl