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4-(4-Methoxyphenyl)-1,5-diphenyl-1H-pyrazole
SpectraBase Compound ID BoGMdJ1Mx1d
InChI InChI=1S/C22H18N2O/c1-25-20-14-12-17(13-15-20)21-16-23-24(19-10-6-3-7-11-19)22(21)18-8-4-2-5-9-18/h2-16H,1H3
InChIKey WAHWEEAUTOESLO-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C22H18N2O
Exact Mass 326.141913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FdvQbGENbXD
Name 4-(4-Methoxyphenyl)-1,5-diphenyl-1H-pyrazole
Comments Computed using HOSE algorithm
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Exact Mass 326.141913207 u
Formula C22H18N2O
InChI InChI=1S/C22H18N2O/c1-25-20-14-12-17(13-15-20)21-16-23-24(19-10-6-3-7-11-19)22(21)18-8-4-2-5-9-18/h2-16H,1H3
InChIKey WAHWEEAUTOESLO-UHFFFAOYSA-N
Molecular Weight 326.399 g/mol
SMILES C=1(N(N=CC1C=1C=CC(=CC1)OC)C1=CC=CC=C1)C=1C=CC=CC1