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METHYL-4-(4-CARBOXYPHENYL)-6-METHYL-4,7-DIHYDRO-1H-PYRAZOLO-[3,4-B]-PYRIDINE-5-CARBOXYLATE
SpectraBase Compound ID Aup9hf50Ke7
InChI InChI=1S/C16H15N3O4/c1-8-12(16(22)23-2)13(11-7-17-19-14(11)18-8)9-3-5-10(6-4-9)15(20)21/h3-7,13H,1-2H3,(H,20,21)(H2,17,18,19)
InChIKey KUUYKXBADRZWSK-UHFFFAOYSA-N
Mol Weight 313.31 g/mol
Molecular Formula C16H15N3O4
Exact Mass 313.106256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4N1Z8g3bLZL
Name METHYL-4-(4-CARBOXYPHENYL)-6-METHYL-4,7-DIHYDRO-1H-PYRAZOLO-[3,4-B]-PYRIDINE-5-CARBOXYLATE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15N3O4
InChI InChI=1S/C16H15N3O4/c1-8-12(16(22)23-2)13(11-7-17-19-14(11)18-8)9-3-5-10(6-4-9)15(20)21/h3-7,13H,1-2H3,(H,20,21)(H2,17,18,19)
InChIKey KUUYKXBADRZWSK-UHFFFAOYSA-N
Literature Reference Author Y.VERDECIA,M.SUAREZ,A.MORALES,E.RODRIGUEZ,E.OCHOA,L.GONZALEZ ,N.MARTIN,M.QUINTEIR
Literature Reference Citation J.CHEM.SOC.PERKIN-1,947(1996)
Literature Reference DOI 10.1039/p19960000947
Molecular Weight 313.313 g/mol
Solvent DMSO-D6
Source File Reference WANG2108