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4-[(4-hydroxyphenyl)amino]-1,3-di(phenyl)pyrazolo[4,5-e]pyridine-5-carboxylic acid ethyl ester
SpectraBase Compound ID Erf3ycpYd2z
InChI InChI=1S/C27H22N4O3/c1-2-34-27(33)22-17-28-26-23(25(22)29-19-13-15-21(32)16-14-19)24(18-9-5-3-6-10-18)30-31(26)20-11-7-4-8-12-20/h3-17,32H,2H2,1H3,(H,28,29)
InChIKey KLGTWDUDMFFZBM-UHFFFAOYSA-N
Mol Weight 450.5 g/mol
Molecular Formula C27H22N4O3
Exact Mass 450.169191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BfzPufR0FGX
Name 4-[(4-hydroxyphenyl)amino]-1,3-di(phenyl)pyrazolo[4,5-e]pyridine-5-carboxylic acid ethyl ester
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H22N4O3
InChI InChI=1S/C27H22N4O3/c1-2-34-27(33)22-17-28-26-23(25(22)29-19-13-15-21(32)16-14-19)24(18-9-5-3-6-10-18)30-31(26)20-11-7-4-8-12-20/h3-17,32H,2H2,1H3,(H,28,29)
InChIKey KLGTWDUDMFFZBM-UHFFFAOYSA-N
Literature Reference Author A.M.R.BERNARDINO,G.A.ROMEIRO,H.DEMELLO,M.C.B.VDESOUZA,V.F.FE RREIRA,M.G.DECARVALH
Literature Reference Citation MAGN.RES.CHEM.,34,730(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199609)34:9<730::aid-omr953>3.0.co;2-s
Molecular Weight 450.497 g/mol
Solvent CDCl3
Source File Reference UWCP831