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4-[[3-(diethylaminomethyl)-4-hydroxy-phenyl]amino]-3-methyl-1-phenyl-pyrazolo[4,5-e]pyridine-5-carboxylic acid ethyl ester

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4-[[3-(diethylaminomethyl)-4-hydroxy-phenyl]amino]-3-methyl-1-phenyl-pyrazolo[4,5-e]pyridine-5-carboxylic acid ethyl ester
SpectraBase Compound ID IHzseF5aeHr
InChI InChI=1S/C27H31N5O3/c1-5-31(6-2)17-19-15-20(13-14-23(19)33)29-25-22(27(34)35-7-3)16-28-26-24(25)18(4)30-32(26)21-11-9-8-10-12-21/h8-16,33H,5-7,17H2,1-4H3,(H,28,29)
InChIKey NFQXLMGYJDIOMQ-UHFFFAOYSA-N
Mol Weight 473.58 g/mol
Molecular Formula C27H31N5O3
Exact Mass 473.24269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3Lss83hFRD
Name 4-[[3-(diethylaminomethyl)-4-hydroxy-phenyl]amino]-3-methyl-1-phenyl-pyrazolo[4,5-e]pyridine-5-carboxylic acid ethyl ester
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H31N5O3
InChI InChI=1S/C27H31N5O3/c1-5-31(6-2)17-19-15-20(13-14-23(19)33)29-25-22(27(34)35-7-3)16-28-26-24(25)18(4)30-32(26)21-11-9-8-10-12-21/h8-16,33H,5-7,17H2,1-4H3,(H,28,29)
InChIKey NFQXLMGYJDIOMQ-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 473.575 g/mol
Solvent CDCl3
Source File Reference UWCP832