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ETHYL-4-OXO-5-(3-OXO-5-PHENYLPENTA-1,4-DIENYLAMINO)-3-PHENYL-3,4-DIHYDROTHIENO-[3,4-D]-PYRIDAZINE-1-CARBOXYLATE
SpectraBase Compound ID 7AyhZSOWaqI
InChI InChI=1S/C26H21N3O4S/c1-2-33-26(32)23-21-17-34-24(22(21)25(31)29(28-23)19-11-7-4-8-12-19)27-16-15-20(30)14-13-18-9-5-3-6-10-18/h3-17,27H,2H2,1H3/b14-13+,16-15-
InChIKey MUPGOFNTGIBZBB-MSBKQZQESA-N
Mol Weight 471.53 g/mol
Molecular Formula C26H21N3O4S
Exact Mass 471.125277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID UMqYVadpyS
Name ETHYL-4-OXO-5-(3-OXO-5-PHENYLPENTA-1,4-DIENYLAMINO)-3-PHENYL-3,4-DIHYDROTHIENO-[3,4-D]-PYRIDAZINE-1-CARBOXYLATE
Compound Number 18A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H21N3O4S
InChI InChI=1S/C26H21N3O4S/c1-2-33-26(32)23-21-17-34-24(22(21)25(31)29(28-23)19-11-7-4-8-12-19)27-16-15-20(30)14-13-18-9-5-3-6-10-18/h3-17,27H,2H2,1H3/b14-13+,16-15-
InChIKey MUPGOFNTGIBZBB-MSBKQZQESA-N
Literature Reference Author B.AL-SALEH,M.A.EL-APASERY
Literature Reference Citation J.HETCYCL.CHEM.,43,559(2006)
Literature Reference DOI 10.1002/jhet.5570430306
Molecular Weight 471.530 g/mol
Sample ID 67344
Solvent CDCl3