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5-HYDROXY-3-PHENYL-5-TRIFLUOROMETHYL-4,5-DIHYDRO-1H-1-(2-FUROYL)-PYRAZOLE
SpectraBase Compound ID DPKlArppLEP
InChI InChI=1S/C15H11F3N2O3/c16-15(17,18)14(22)9-11(10-5-2-1-3-6-10)19-20(14)13(21)12-7-4-8-23-12/h1-8,22H,9H2
InChIKey ICSXAMDMZIUDCV-UHFFFAOYSA-N
Mol Weight 324.26 g/mol
Molecular Formula C15H11F3N2O3
Exact Mass 324.072177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4aS8it4EWMG
Name 5-HYDROXY-3-PHENYL-5-TRIFLUOROMETHYL-4,5-DIHYDRO-1H-1-(2-FUROYL)-PYRAZOLE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H11F3N2O3
InChI InChI=1S/C15H11F3N2O3/c16-15(17,18)14(22)9-11(10-5-2-1-3-6-10)19-20(14)13(21)12-7-4-8-23-12/h1-8,22H,9H2
InChIKey ICSXAMDMZIUDCV-UHFFFAOYSA-N
Literature Reference Author H.G.BONACORSO,M.R.OLIVEIRA,M.B.COSTA,L.B.D.SILVA,A.D.WASTOWS KI,N.ZANATTA,M.A.P.M
Literature Reference Citation J.HETCYCL.CHEM.,42,631(2005)
Literature Reference DOI 10.1002/jhet.5570420424
Molecular Weight 324.259 g/mol
Sample ID 53111
Solvent DMSO-D6