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1-[(2-hydroxy-1-methylol-ethoxy)methyl]-5-nitro-pyrimidine-2,4-quinone
SpectraBase Compound ID 3zxYRpLgtt7
InChI InChI=1S/C8H11N3O7/c12-2-5(3-13)18-4-10-1-6(11(16)17)7(14)9-8(10)15/h1,5,12-13H,2-4H2,(H,9,14,15)
InChIKey QFYNDFMNDNTZAN-UHFFFAOYSA-N
Mol Weight 261.19 g/mol
Molecular Formula C8H11N3O7
Exact Mass 261.0597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G7ANfClM9EZ
Name 1-[(2-hydroxy-1-methylol-ethoxy)methyl]-5-nitro-pyrimidine-2,4-quinone
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11N3O7
InChI InChI=1S/C8H11N3O7/c12-2-5(3-13)18-4-10-1-6(11(16)17)7(14)9-8(10)15/h1,5,12-13H,2-4H2,(H,9,14,15)
InChIKey QFYNDFMNDNTZAN-UHFFFAOYSA-N
Literature Reference Author K.K.OGILVIE,R.G.HAMILTON,M.F.GILLEN,B.K.RADATUS,K.O.SMITH,K. S.GALLOWAY
Literature Reference Citation CAN.J.CHEM.,62,16(1984)
Literature Reference DOI 10.1139/v84-004
Molecular Weight 261.191 g/mol
Solvent DMSO-D6
Source File Reference UWED3264