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5-(4-BROMOPHENYL)-1-(1,1-DIMETHYLETHYL)-3-TRIFLUOROMETHYL-1H-PYRAZOLE
SpectraBase Compound ID 4KLPXEWdQNl
InChI InChI=1S/C14H14BrF3N2/c1-13(2,3)20-11(8-12(19-20)14(16,17)18)9-4-6-10(15)7-5-9/h4-8H,1-3H3
InChIKey RXNUBRDOQCIIKL-UHFFFAOYSA-N
Mol Weight 347.18 g/mol
Molecular Formula C14H14BrF3N2
Exact Mass 346.029246 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8E7m426Oy5i
Name 5-(4-BROMOPHENYL)-1-(1,1-DIMETHYLETHYL)-3-TRIFLUOROMETHYL-1H-PYRAZOLE
Compound Number 3H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14BrF3N2
InChI InChI=1S/C14H14BrF3N2/c1-13(2,3)20-11(8-12(19-20)14(16,17)18)9-4-6-10(15)7-5-9/h4-8H,1-3H3
InChIKey RXNUBRDOQCIIKL-UHFFFAOYSA-N
Literature Reference Author M.A.P.MARTINS,M.R.B.MARZARI,C.P.FRIZZO,M.ZANATTA,L.BURIOL,V. P.ANDRADE,N.ZANATTA,
Literature Reference Citation EUR.J.ORG.CHEM.,2012,7112(2012)
Literature Reference DOI 10.1002/ejoc.201201111
Molecular Weight 347.178 g/mol
Solvent CDCl3
Source File Reference UWLU83523