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1-(4-BROMO-2,3,5,6-TETRAFLUOROPHENYL)-5-FLUORO-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-1H-PYRAZOLE
SpectraBase Compound ID H3w8CSJjbw8
InChI InChI=1S/C12BrF13N2/c13-2-3(14)5(16)7(6(17)4(2)15)28-9(18)1(11(21,22)23)8(27-28)10(19,20)12(24,25)26
InChIKey IAYODRNXGVPJPV-UHFFFAOYSA-N
Mol Weight 499.03 g/mol
Molecular Formula C12BrF13N2
Exact Mass 497.903727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 72r0AH9lMNS
Name 1-(4-BROMO-2,3,5,6-TETRAFLUOROPHENYL)-5-FLUORO-3-PENTAFLUOROETHYL-4-TRIFLUOROMETHYL-1H-PYRAZOLE
Compound Number XXI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12BrF13N2
InChI InChI=1S/C12BrF13N2/c13-2-3(14)5(16)7(6(17)4(2)15)28-9(18)1(11(21,22)23)8(27-28)10(19,20)12(24,25)26
InChIKey IAYODRNXGVPJPV-UHFFFAOYSA-N
Literature Reference Author G.G.FURIN,K.W.CHI,N.I.PROTSUK,V.A.LOPYREV
Literature Reference Citation RUSS.J.ORG.CHEM.,37,1621(2001)
Literature Reference DOI 10.1023/A:1013876707892
Molecular Weight 499.029 g/mol
Solvent CDCl3
Source File Reference UWMZ10496