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[5A,8-(13)-C-(2)]-RIBOFLAVIN

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[5A,8-(13)-C-(2)]-RIBOFLAVIN
SpectraBase Compound ID 3qPO2wN5wW1
InChI InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/i8+1,9+1
InChIKey AUNGANRZJHBGPY-IOOOXAEESA-N
Mol Weight 378.35 g/mol
Molecular Formula C1513C2H20N4O6
Exact Mass 378.144994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C21Y2GcuW7i
Name [5A,8-(13)-C-(2)]-RIBOFLAVIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20N4O6
InChI InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/i8+1,9+1
InChIKey AUNGANRZJHBGPY-IOOOXAEESA-N
Literature Reference Author W.ROEMISCH,W.EISENREICH,G.RICHTER,A.BACHER
Literature Reference Citation J.ORG.CHEM.,67,8890(2002)
Literature Reference DOI 10.1021/jo026105x
Molecular Weight 376.369 g/mol
Solvent D2O
Source File Reference UWVN23967