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3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid, o-piperidinophenyl ester
SpectraBase Compound ID Af9CqMS9Xc8
InChI InChI=1S/C22H20ClFN2O3/c1-14-19(21(25-29-14)20-15(23)8-7-9-16(20)24)22(27)28-18-11-4-3-10-17(18)26-12-5-2-6-13-26/h3-4,7-11H,2,5-6,12-13H2,1H3
InChIKey WPZZYPUHIUMEOM-UHFFFAOYSA-N
Mol Weight 414.86 g/mol
Molecular Formula C22H20ClFN2O3
Exact Mass 414.114648 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FaV6nVb0QL5
Name 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid, o-piperidinophenyl ester
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Formula C22H20ClFN2O3
InChI InChI=1S/C22H20ClFN2O3/c1-14-19(21(25-29-14)20-15(23)8-7-9-16(20)24)22(27)28-18-11-4-3-10-17(18)26-12-5-2-6-13-26/h3-4,7-11H,2,5-6,12-13H2,1H3
InChIKey WPZZYPUHIUMEOM-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 39080M
Solvent CDCl3