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dimethyl 5-(6-methoxy-5-nitroquinolin-2-yl)-1,2,4-triazine-3,6-dicarboxylate
SpectraBase Compound ID KN8fvsxlvDn
InChI InChI=1S/C17H13N5O7/c1-27-11-7-6-9-8(14(11)22(25)26)4-5-10(18-9)12-13(16(23)28-2)20-21-15(19-12)17(24)29-3/h4-7H,1-3H3
InChIKey XCYVWEFNNZFPTL-UHFFFAOYSA-N
Mol Weight 399.32 g/mol
Molecular Formula C17H13N5O7
Exact Mass 399.081498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9NJSpM9Cfac
Name dimethyl 5-(6-methoxy-5-nitroquinolin-2-yl)-1,2,4-triazine-3,6-dicarboxylate
CAS Registry Number 83220-12-6
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13N5O7
InChI InChI=1S/C17H13N5O7/c1-27-11-7-6-9-8(14(11)22(25)26)4-5-10(18-9)12-13(16(23)28-2)20-21-15(19-12)17(24)29-3/h4-7H,1-3H3
InChIKey XCYVWEFNNZFPTL-UHFFFAOYSA-N
Literature Reference Author D.L.BOGER,J.S.PANEK
Literature Reference Citation J.ORG.CHEM.,48,621(1983)
Literature Reference DOI 10.1021/jo00152a049
Molecular Weight 399.320 g/mol
Solvent DMSO-D6
Source File Reference UNIW20186