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4-{1-[(m-chlorophenyl)carbamoyl]pyrazol-5-yl}-5-methyl-3-isoxazolecarboxylic acid, methyl ester
SpectraBase Compound ID 6ReiuLgMTIV
InChI InChI=1S/C16H13ClN4O4/c1-9-13(14(20-25-9)15(22)24-2)12-6-7-18-21(12)16(23)19-11-5-3-4-10(17)8-11/h3-8H,1-2H3,(H,19,23)
InChIKey VJVVXZCJLOGXTL-UHFFFAOYSA-N
Mol Weight 360.76 g/mol
Molecular Formula C16H13ClN4O4
Exact Mass 360.062533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BjPLLbSBeAa
Name 4-{1-[(m-CHLOROPHENYL)CARBAMOYL]PYRAZOL-5-YL}-5-METHYL-3-ISOXAZOLE-CARBOXYLIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClN4O4
InChI InChI=1S/C16H13ClN4O4/c1-9-13(14(20-25-9)15(22)24-2)12-6-7-18-21(12)16(23)19-11-5-3-4-10(17)8-11/h3-8H,1-2H3,(H,19,23)
InChIKey VJVVXZCJLOGXTL-UHFFFAOYSA-N
Molecular Weight 360.76
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 3-ISOXAZOLECARBOXYLIC ACID, 4-/1-//M-CHLOROPHENYL/CARBAMOYL/PYRAZ- OL-5-YL/-5-METHYL-, METHYL ESTER 3-ISOXAZOLECARBOXYLIC ACID, 4-/1-//M-CHLOROPHENYL/CARBAMOYL/PYRAZ- OL-5-YL/-5-METHYL-, METHYL ESTER