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3,5-Dimethyl-4-ethoxycarbonyl-1-(4-nitro-phenyl)-1,4,4a,5,10,10a-hexahydro-pyridazino(3,4-B)quinoxaline

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3,5-Dimethyl-4-ethoxycarbonyl-1-(4-nitro-phenyl)-1,4,4a,5,10,10a-hexahydro-pyridazino(3,4-B)quinoxaline
SpectraBase Compound ID InCRe3gGYEx
InChI InChI=1S/C21H23N5O4/c1-4-30-21(27)18-13(2)23-25(14-9-11-15(12-10-14)26(28)29)20-19(18)24(3)17-8-6-5-7-16(17)22-20/h5-12,18-20,22H,4H2,1-3H3
InChIKey ILXQZKAEWIAYTB-UHFFFAOYSA-N
Mol Weight 409.45 g/mol
Molecular Formula C21H23N5O4
Exact Mass 409.175004 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZk8Am3Hj8L
Name 3,5-Dimethyl-4-ethoxycarbonyl-1-(4-nitro-phenyl)-1,4,4a,5,10,10a-hexahydro-pyridazino(3,4-B)quinoxaline
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H23N5O4
InChI InChI=1S/C21H23N5O4/c1-4-30-21(27)18-13(2)23-25(14-9-11-15(12-10-14)26(28)29)20-19(18)24(3)17-8-6-5-7-16(17)22-20/h5-12,18-20,22H,4H2,1-3H3
InChIKey ILXQZKAEWIAYTB-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference V.N. Charushin, N.N. Sorokin, O.N. Chupakhin, Magn. Res. Chem. 24, 777 (1986).
NMR Standard Dioxane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6