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MANSOURAMYCIN_C;3-CARBOMETHOXY-7-METHYLAMINOISOQUINOLINE-5,8-DIONE
SpectraBase Compound ID 3Gwo5YSEYQ
InChI InChI=1S/C12H10N2O4/c1-13-8-4-10(15)6-3-9(12(17)18-2)14-5-7(6)11(8)16/h3-5,13H,1-2H3
InChIKey PQDLBACRSRBAGV-UHFFFAOYSA-N
Mol Weight 246.22 g/mol
Molecular Formula C12H10N2O4
Exact Mass 246.064057 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HkUjm3pyYDl
Name MANSOURAMYCIN_C;3-CARBOMETHOXY-7-METHYLAMINOISOQUINOLINE-5,8-DIONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10N2O4
InChI InChI=1S/C12H10N2O4/c1-13-8-4-10(15)6-3-9(12(17)18-2)14-5-7(6)11(8)16/h3-5,13H,1-2H3
InChIKey PQDLBACRSRBAGV-UHFFFAOYSA-N
Literature Reference Author U.W.HAWAS,M.SHAABAN,K.A.SHAABAN,M.SPEITLING,A.MAIER,G.KELTER ,H.H.FIEBIG,M.MAINER
Literature Reference Citation J.NAT.PROD.,72,2120(2009)
Literature Reference DOI 10.1021/np900160g
Molecular Weight 246.222 g/mol
Sample ID 34207
Solvent CDCl3