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7-IODO-6-METHYL-1,4-DIHYDRO-PYRIDO-[2,3-B]-PYRAZINE-2,3-DIONE-N-OXIDE
SpectraBase Compound ID EoJmXlWMqwC
InChI InChI=1S/C8H6IN3O3/c1-3-4(9)2-5-6(12(3)15)11-8(14)7(13)10-5/h2H,1H3,(H,10,13)(H,11,14)
InChIKey BCQPSXNCULRIAT-UHFFFAOYSA-N
Mol Weight 319.06 g/mol
Molecular Formula C8H6IN3O3
Exact Mass 318.945386 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CsQ3Wcl7ixA
Name 7-IODO-6-METHYL-1,4-DIHYDRO-PYRIDO-[2,3-B]-PYRAZINE-2,3-DIONE-N-OXIDE
Compound Number 19B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H6IN3O3
InChI InChI=1S/C8H6IN3O3/c1-3-4(9)2-5-6(12(3)15)11-8(14)7(13)10-5/h2H,1H3,(H,10,13)(H,11,14)
InChIKey BCQPSXNCULRIAT-UHFFFAOYSA-N
Literature Reference Author S.PROVERA,C.MARCHIORO,S.DAVAILLI,N.CASE
Literature Reference Citation MAGN.RES.CHEM.,35,342(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199705)35:5<342::aid-omr81>3.3.co;2-d
Molecular Weight 319.058 g/mol
Solvent DMSO-D6
Source File Reference UWCP5098