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(E)-3(5)-[BETA-(2-FLUORO-4-HYDROXYPHENYL)-ETHENYL]-5(3)-PHENYL-1H-PYRAZOLE;MAJOR-ISOMER
SpectraBase Compound ID 9410uaRzD7C
InChI InChI=1S/C17H13FN2O/c18-16-11-15(21)9-7-12(16)6-8-14-10-17(20-19-14)13-4-2-1-3-5-13/h1-11,21H,(H,19,20)/b8-6+
InChIKey WXEGWJDPNQMRIJ-SOFGYWHQSA-N
Mol Weight 280.3 g/mol
Molecular Formula C17H13FN2O
Exact Mass 280.101191 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GilEkbGGDN5
Name (E)-3(5)-[BETA-(2-FLUORO-4-HYDROXYPHENYL)-ETHENYL]-5(3)-PHENYL-1H-PYRAZOLE;MINOR-ISOMER
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13FN2O
InChI InChI=1S/C17H13FN2O/c18-16-11-15(21)9-7-12(16)6-8-14-10-17(20-19-14)13-4-2-1-3-5-13/h1-11,21H,(H,19,20)/b8-6+
InChIKey WXEGWJDPNQMRIJ-SOFGYWHQSA-N
Literature Reference Author C.I.NIETO,M.P.CABILDO,M.P.CORNAGO,D.SANZ,R.M.CLARAMUNT,M.C.T ORRALBA,M.R.TORRES,J
Literature Reference Citation MOLECULES,20,15643(2015)
Literature Reference DOI 10.3390/molecules200915643
Solvent DMSO-D6
Source File Reference UWPA6001