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RWHQJHRWFRFTSE-UHFFFAOYSA-N
SpectraBase Compound ID 1zRBEF2cQFb
InChI InChI=1S/C7H9N5O4/c1-12-6(15)4(11-16)5(8)10-7(12)9-2-3(13)14/h2,8H2,1H3,(H,9,10)(H,13,14)
InChIKey RWHQJHRWFRFTSE-UHFFFAOYSA-N
Mol Weight 227.18 g/mol
Molecular Formula C7H9N5O4
Exact Mass 227.065454 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABfatQkyz3L
Name 2-[(4-AMINO-3-METHYL-5-NITROSO-6-OXO-1,6-DIHYDRO)-PYRIMIDIN-2-YL]-AMINOACETIC-ACID-DIHYDRATE
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H9N5O4
InChI InChI=1S/C7H9N5O4/c1-12-6(15)4(11-16)5(8)10-7(12)9-2-3(13)14/h2,8H2,1H3,(H,9,10)(H,13,14)
InChIKey RWHQJHRWFRFTSE-UHFFFAOYSA-N
Literature Reference Author M.MELGUIZO,A.MARCHAL,M.NOGUERAS,A.SANCHEZ,J.N.LOW
Literature Reference Citation J.HETCYCL.CHEM.,39,97(2002)
Literature Reference DOI 10.1002/jhet.5570390114
Molecular Weight 227.180 g/mol
Solvent DMSO-D6
Source File Reference UWSI8513