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4-[1-(p-chlorobenzoyl)pyrazol-5-yl]-5-methyl-3-isoxazolecarboxylic acid, methyl ester

View entire compound with spectra: 3 NMR, and 1 FTIR

4-[1-(p-chlorobenzoyl)pyrazol-5-yl]-5-methyl-3-isoxazolecarboxylic acid, methyl ester
SpectraBase Compound ID 5Nx9S5dTuYe
InChI InChI=1S/C16H12ClN3O4/c1-9-13(14(19-24-9)16(22)23-2)12-7-8-18-20(12)15(21)10-3-5-11(17)6-4-10/h3-8H,1-2H3
InChIKey YCFXYWCBEFQHER-UHFFFAOYSA-N
Mol Weight 345.74 g/mol
Molecular Formula C16H12ClN3O4
Exact Mass 345.051634 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 620OWLdO6jv
Name 4-[1-(p-CHLOROBENZOYL)PYRAZOL-5-YL]-5-METHYL-3-ISOXAZOLECARBOXYLIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClN3O4
InChI InChI=1S/C16H12ClN3O4/c1-9-13(14(19-24-9)16(22)23-2)12-7-8-18-20(12)15(21)10-3-5-11(17)6-4-10/h3-8H,1-2H3
InChIKey YCFXYWCBEFQHER-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 345.74
Solvent CDCl3; Reference=TMS; Temperature 297K