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4-[[3-(diethylaminomethyl)-4-hydroxy-phenyl]amino]-1,3-di(phenyl)pyrazolo[4,5-e]pyridine-5-carboxylic acid ethyl ester
SpectraBase Compound ID BFGKGUszoAb
InChI InChI=1S/C32H33N5O3/c1-4-36(5-2)21-23-19-24(17-18-27(23)38)34-30-26(32(39)40-6-3)20-33-31-28(30)29(22-13-9-7-10-14-22)35-37(31)25-15-11-8-12-16-25/h7-20,38H,4-6,21H2,1-3H3,(H,33,34)
InChIKey XZQQAQOYFRNUOR-UHFFFAOYSA-N
Mol Weight 535.6 g/mol
Molecular Formula C32H33N5O3
Exact Mass 535.25834 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GGOFoqAb02A
Name 4-[[3-(diethylaminomethyl)-4-hydroxy-phenyl]amino]-1,3-di(phenyl)pyrazolo[4,5-e]pyridine-5-carboxylic acid ethyl ester
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H33N5O3
InChI InChI=1S/C32H33N5O3/c1-4-36(5-2)21-23-19-24(17-18-27(23)38)34-30-26(32(39)40-6-3)20-33-31-28(30)29(22-13-9-7-10-14-22)35-37(31)25-15-11-8-12-16-25/h7-20,38H,4-6,21H2,1-3H3,(H,33,34)
InChIKey XZQQAQOYFRNUOR-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 535.646 g/mol
Solvent DMSO-D6
Source File Reference UWCP833