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1-ETHYL-1,4-DIHYDRO-7-[(1-IMIDAZOYL)-PHENYLMETHYL]-6-METHOXY-4-OXO-3-QUINOLINE-CARBOXYLIC-ACID
SpectraBase Compound ID FvCisMxJ5yT
InChI InChI=1S/C23H21N3O4/c1-3-25-13-18(23(28)29)22(27)16-12-20(30-2)17(11-19(16)25)21(26-10-9-24-14-26)15-7-5-4-6-8-15/h4-14,21H,3H2,1-2H3,(H,28,29)
InChIKey FXXIKTZGTDMAOM-UHFFFAOYSA-N
Mol Weight 403.44 g/mol
Molecular Formula C23H21N3O4
Exact Mass 403.153206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwepkLvt0lO
Name 1-ETHYL-1,4-DIHYDRO-7-[(1-IMIDAZOYL)-PHENYLMETHYL]-6-METHOXY-4-OXO-3-QUINOLINE-CARBOXYLIC-ACID
Compound Number 1 0C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H21N3O4
InChI InChI=1S/C23H21N3O4/c1-3-25-13-18(23(28)29)22(27)16-12-20(30-2)17(11-19(16)25)21(26-10-9-24-14-26)15-7-5-4-6-8-15/h4-14,21H,3H2,1-2H3,(H,28,29)
InChIKey FXXIKTZGTDMAOM-UHFFFAOYSA-N
Literature Reference Author J.FRIGOLA,A.COLOMBO,J.MAS,J.PARES
Literature Reference Citation J.HETCYCL.CHEM.,24,399(1987)
Literature Reference DOI 10.1002/jhet.5570240220
Molecular Weight 403.437 g/mol
Solvent DMSO-D6
Source File Reference UWED7399