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5-HYDROXY-5-TRIFLUOROMETHYL-4,5-DIHYDRO-1H-1-(2-FUROYL)-PYRAZOLE
SpectraBase Compound ID Fjmpe7A66IC
InChI InChI=1S/C9H7F3N2O3/c10-9(11,12)8(16)3-4-13-14(8)7(15)6-2-1-5-17-6/h1-2,4-5,16H,3H2
InChIKey ORUKFGWMFDGDJX-UHFFFAOYSA-N
Mol Weight 248.16 g/mol
Molecular Formula C9H7F3N2O3
Exact Mass 248.040877 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ewj0t1gunjZ
Name 5-HYDROXY-5-TRIFLUOROMETHYL-4,5-DIHYDRO-1H-1-(2-FUROYL)-PYRAZOLE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7F3N2O3
InChI InChI=1S/C9H7F3N2O3/c10-9(11,12)8(16)3-4-13-14(8)7(15)6-2-1-5-17-6/h1-2,4-5,16H,3H2
InChIKey ORUKFGWMFDGDJX-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 248.161 g/mol
Sample ID 53109
Solvent DMSO-D6