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1-(3-CHLOROPHENYL)-3-METHYL-4-(PHENOXYDIFLUOROMETHYL)-6-HYDROXYPYRAZOLO-[3,4-B]-PYRIDINE
SpectraBase Compound ID 9FenoOOcKTR
InChI InChI=1S/C20H14ClF2N3O2/c1-12-18-16(20(22,23)28-15-8-3-2-4-9-15)11-17(27)24-19(18)26(25-12)14-7-5-6-13(21)10-14/h2-11H,1H3,(H,24,27)
InChIKey MBSLAMBXGCTRLI-UHFFFAOYSA-N
Mol Weight 401.8 g/mol
Molecular Formula C20H14ClF2N3O2
Exact Mass 401.074261 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Q4z81yNZw6
Name 1-(3-CHLOROPHENYL)-3-METHYL-4-(PHENOXYDIFLUOROMETHYL)-6-HYDROXYPYRAZOLO-[3,4-B]-PYRIDINE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H14ClF2N3O2
InChI InChI=1S/C20H14ClF2N3O2/c1-12-18-16(20(22,23)28-15-8-3-2-4-9-15)11-17(27)24-19(18)26(25-12)14-7-5-6-13(21)10-14/h2-11H,1H3,(H,24,27)
InChIKey MBSLAMBXGCTRLI-UHFFFAOYSA-N
Literature Reference Author S.Y.SOLODUKHIN,A.S.PEREGUDOV,E.V.VORONTSOV,N.D.CHKANIKOV
Literature Reference Citation MOLECULES,9,164(2004)
Literature Reference DOI 10.3390/90300164
Solvent DMSO-D6
Source File Reference UWMS5871