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1-(2-chlorophenyl)-3,5-bis(2,4-dimethylphenyl)-1H-pyrazole

View entire compound with spectra: 2 NMR

1-(2-chlorophenyl)-3,5-bis(2,4-dimethylphenyl)-1H-pyrazole
SpectraBase Compound ID EOcH3lUsndQ
InChI InChI=1S/C25H23ClN2/c1-16-9-11-20(18(3)13-16)23-15-25(21-12-10-17(2)14-19(21)4)28(27-23)24-8-6-5-7-22(24)26/h5-15H,1-4H3
InChIKey SGHMUMOFJSSKSH-UHFFFAOYSA-N
Mol Weight 386.93 g/mol
Molecular Formula C25H23ClN2
Exact Mass 386.154976 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GtHDtTGh3sO
Name 1-(2-Chlorophenyl)-3,5-bis(2,4-dimethylphenyl)-1H-pyrazole
Comments Computed using HOSE algorithm
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Exact Mass 386.154976449 u
Formula C25H23ClN2
InChI InChI=1S/C25H23ClN2/c1-16-9-11-20(18(3)13-16)23-15-25(21-12-10-17(2)14-19(21)4)28(27-23)24-8-6-5-7-22(24)26/h5-15H,1-4H3
InChIKey SGHMUMOFJSSKSH-UHFFFAOYSA-N
Molecular Weight 386.926 g/mol
SMILES C=1C=C(C(Cl)=CC1)N1C(=CC(=N1)C=1C(=CC(C)=CC1)C)C=1C(=CC(C)=CC1)C