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4-(4-FLUOROPHENYL)-5-(4-METHYLSULFONYLPHENYL)-3-METHYL-ISOXAZOLE

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4-(4-FLUOROPHENYL)-5-(4-METHYLSULFONYLPHENYL)-3-METHYL-ISOXAZOLE
SpectraBase Compound ID JeuoboDyOmK
InChI InChI=1S/C17H14FNO3S/c1-11-16(12-3-7-14(18)8-4-12)17(22-19-11)13-5-9-15(10-6-13)23(2,20)21/h3-10H,1-2H3
InChIKey RFMPOLCSSNYYIM-UHFFFAOYSA-N
Mol Weight 331.36 g/mol
Molecular Formula C17H14FNO3S
Exact Mass 331.067843 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CKpcPl5C0S0
Name 4-(4-FLUOROPHENYL)-5-(4-METHYLSULFONYLPHENYL)-3-METHYL-ISOXAZOLE
Compound Number 11K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14FNO3S
InChI InChI=1S/C17H14FNO3S/c1-11-16(12-3-7-14(18)8-4-12)17(22-19-11)13-5-9-15(10-6-13)23(2,20)21/h3-10H,1-2H3
InChIKey RFMPOLCSSNYYIM-UHFFFAOYSA-N
Literature Reference Author A.G.HABEEB,P.N.P.RAO,E.E.KNAUS
Literature Reference Citation J.MED.CHEM.,44,2921(2001)
Literature Reference DOI 10.1021/jm0101287
Solvent CDCl3
Source File Reference UWSI45063