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METHYL-2-[3',4'-DICARBOMETHOXY-5'-(4''-METHOXYPHENYL)-1'-PYRAZOLYL]-3-CARBOMETHOXY-4-(4''-METHOXYPHENYL)-BUT-3-ENOATE
SpectraBase Compound ID HrJeC1Mc4K
InChI InChI=1S/C28H28N2O10/c1-35-18-11-7-16(8-12-18)15-20(25(31)37-3)24(28(34)40-6)30-23(17-9-13-19(36-2)14-10-17)21(26(32)38-4)22(29-30)27(33)39-5/h7-15,24H,1-6H3/b20-15-
InChIKey JRNDUWFOAQXERJ-HKWRFOASSA-N
Mol Weight 552.54 g/mol
Molecular Formula C28H28N2O10
Exact Mass 552.174395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1wIHOhe89lo
Name METHYL-2-[3',4'-DICARBOMETHOXY-5'-(4''-METHOXYPHENYL)-1'-PYRAZOLYL]-3-CARBOMETHOXY-4-(4''-METHOXYPHENYL)-BUT-3-ENOATE
Compound Number 49
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H28N2O10
InChI InChI=1S/C28H28N2O10/c1-35-18-11-7-16(8-12-18)15-20(25(31)37-3)24(28(34)40-6)30-23(17-9-13-19(36-2)14-10-17)21(26(32)38-4)22(29-30)27(33)39-5/h7-15,24H,1-6H3/b20-15-
InChIKey JRNDUWFOAQXERJ-HKWRFOASSA-N
Literature Reference Author A.EL-ALALI,A.S.AL-KAMALI
Literature Reference Citation CAN.J.CHEM.,80,1293(2002)
Literature Reference DOI 10.1139/v02-169
Molecular Weight 552.538 g/mol
Solvent CDCl3
Source File Reference UWVN27333