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5-AMINO-1-BENZYLOXY-4-CYANO-6-IMINO-1,6-DIHYDROPYRIMIDINE
SpectraBase Compound ID Ki1RRESAIK3
InChI InChI=1S/C12H11N5O/c13-6-10-11(14)12(15)17(8-16-10)18-7-9-4-2-1-3-5-9/h1-5,8,15H,7,14H2
InChIKey NDPGXTSMVSAWHD-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C12H11N5O
Exact Mass 241.09636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9DRpUurpPS3
Name 5-AMINO-1-BENZYLOXY-4-CYANO-6-IMINO-1,6-DIHYDROPYRIMIDINE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11N5O
InChI InChI=1S/C12H11N5O/c13-6-10-11(14)12(15)17(8-16-10)18-7-9-4-2-1-3-5-9/h1-5,8,15H,7,14H2
InChIKey NDPGXTSMVSAWHD-UHFFFAOYSA-N
Literature Reference Author B.L.BOOTH,F.A.T.COSTA,Z.MAHMOOD,G.R.PRITCHARD,M.F.PROENCA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1853(1999)
Literature Reference DOI 10.1039/a901332f
Molecular Weight 241.252 g/mol
Solvent DMSO-D6
Source File Reference UWRU5605