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3-(2'-BROMOPHENYL)-4,4-DIMETHYL-5-PHENYL-4H-PYRAZOLE
SpectraBase Compound ID ABjq8AwVdfV
InChI InChI=1S/C17H15BrN2/c1-17(2)15(12-8-4-3-5-9-12)19-20-16(17)13-10-6-7-11-14(13)18/h3-11H,1-2H3
InChIKey CKPCNZFOKICSJW-UHFFFAOYSA-N
Mol Weight 327.23 g/mol
Molecular Formula C17H15BrN2
Exact Mass 326.041861 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FtK8522tEDE
Name 3-(2'-BROMOPHENYL)-4,4-DIMETHYL-5-PHENYL-4H-PYRAZOLE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15BrN2
InChI InChI=1S/C17H15BrN2/c1-17(2)15(12-8-4-3-5-9-12)19-20-16(17)13-10-6-7-11-14(13)18/h3-11H,1-2H3
InChIKey CKPCNZFOKICSJW-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 327.224 g/mol
Solvent CDCl3
Source File Reference UWRU11077