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4-(4-METHOXYBENZOYL)-5-(4-METHOXYPHENYL)-1-(2,4-DINITROPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC-ACID-2,4-DINITROPHENYL-HYDRAZIDE
SpectraBase Compound ID D8ypwiLuP33
InChI InChI=1S/C31H22N8O12/c1-50-21-9-3-17(4-10-21)29-27(30(40)18-5-11-22(51-2)12-6-18)28(34-35(29)24-14-8-20(37(44)45)16-26(24)39(48)49)31(41)33-32-23-13-7-19(36(42)43)15-25(23)38(46)47/h3-16,32H,1-2H3,(H,33,41)
InChIKey PKUURIDENNWILT-UHFFFAOYSA-N
Mol Weight 698.56 g/mol
Molecular Formula C31H22N8O12
Exact Mass 698.135718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GKHlQzgZZZA
Name 4-(4-METHOXYBENZOYL)-5-(4-METHOXYPHENYL)-1-(2,4-DINITROPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC-ACID-2,4-DINITROPHENYL-HYDRAZIDE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H22N8O12
InChI InChI=1S/C31H22N8O12/c1-50-21-9-3-17(4-10-21)29-27(30(40)18-5-11-22(51-2)12-6-18)28(34-35(29)24-14-8-20(37(44)45)16-26(24)39(48)49)31(41)33-32-23-13-7-19(36(42)43)15-25(23)38(46)47/h3-16,32H,1-2H3,(H,33,41)
InChIKey PKUURIDENNWILT-UHFFFAOYSA-N
Literature Reference Author I.O.ILHAN,E.SARIPINAR,Y.AKCAMUR
Literature Reference Citation J.HETCYCL.CHEM.,42,117(2005)
Literature Reference DOI 10.1002/jhet.5570420117
Molecular Weight 698.562 g/mol
Sample ID 42343
Solvent CDCl3