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MANSOURAMYCIN_A;7-METHYLAMINO-3,4-DIMETHYLISOQUINOLINE-5,8-DIONE
SpectraBase Compound ID CgXH3nFDeCn
InChI InChI=1S/C12H12N2O2/c1-6-7(2)14-5-8-11(6)10(15)4-9(13-3)12(8)16/h4-5,13H,1-3H3
InChIKey SDLNCVBYFYLESJ-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C12H12N2O2
Exact Mass 216.089878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7OGT1l5HW2m
Name MANSOURAMYCIN_A;7-METHYLAMINO-3,4-DIMETHYLISOQUINOLINE-5,8-DIONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12N2O2
InChI InChI=1S/C12H12N2O2/c1-6-7(2)14-5-8-11(6)10(15)4-9(13-3)12(8)16/h4-5,13H,1-3H3
InChIKey SDLNCVBYFYLESJ-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 216.239 g/mol
Sample ID 34206
Solvent CDCl3