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1-(3,4-dichlorophenyl)-3,5-bis(4-methylphenyl)-1H-pyrazole

View entire compound with spectra: 2 NMR

1-(3,4-dichlorophenyl)-3,5-bis(4-methylphenyl)-1H-pyrazole
SpectraBase Compound ID JVy0yMnl9cq
InChI InChI=1S/C23H18Cl2N2/c1-15-3-7-17(8-4-15)22-14-23(18-9-5-16(2)6-10-18)27(26-22)19-11-12-20(24)21(25)13-19/h3-14H,1-2H3
InChIKey XKKJSHAZTWQWGN-UHFFFAOYSA-N
Mol Weight 393.32 g/mol
Molecular Formula C23H18Cl2N2
Exact Mass 392.084704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FYa1f3pWvco
Name 1-(3,4-Dichlorophenyl)-3,5-bis(4-methylphenyl)-1H-pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.084703988 u
Formula C23H18Cl2N2
InChI InChI=1S/C23H18Cl2N2/c1-15-3-7-17(8-4-15)22-14-23(18-9-5-16(2)6-10-18)27(26-22)19-11-12-20(24)21(25)13-19/h3-14H,1-2H3
InChIKey XKKJSHAZTWQWGN-UHFFFAOYSA-N
Molecular Weight 393.317 g/mol
SMILES C=1C(=CC(=C(C1)Cl)Cl)N1N=C(C=2C=CC(=CC2)C)C=C1C1=CC=C(C)C=C1