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4,4-DIMETHYL-3-(2'-METHYLPHENYL)-5-PHENYL-4H-PYRAZOLE
SpectraBase Compound ID 6kCOnRLColK
InChI InChI=1S/C18H18N2/c1-13-9-7-8-12-15(13)17-18(2,3)16(19-20-17)14-10-5-4-6-11-14/h4-12H,1-3H3
InChIKey RNJQFGWTNHBFEZ-UHFFFAOYSA-N
Mol Weight 262.36 g/mol
Molecular Formula C18H18N2
Exact Mass 262.146999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1moPgfNkymE
Name 4,4-DIMETHYL-3-(2'-METHYLPHENYL)-5-PHENYL-4H-PYRAZOLE
Compound Number 6E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18N2
InChI InChI=1S/C18H18N2/c1-13-9-7-8-12-15(13)17-18(2,3)16(19-20-17)14-10-5-4-6-11-14/h4-12H,1-3H3
InChIKey RNJQFGWTNHBFEZ-UHFFFAOYSA-N
Literature Reference Author W.ADAM,C.VANBARNEVELD,J.S.GERKE,F.G.KLAERNER
Literature Reference Citation J.CHEM.SOC.PERKIN-2,2723(1999)
Literature Reference DOI 10.1039/a905773k
Molecular Weight 262.354 g/mol
Solvent CDCl3
Source File Reference UWRU11078