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2-(N,N-DIMETHYLAMINOMETHYLENEAMINO)-6-[2-(N-METHOXY-N-METHYLCARBAMOYL)-VINYL]-PTERIDIN-4(3H)-ONE
SpectraBase Compound ID Ca2JqkIBrfG
InChI InChI=1S/C14H17N7O3/c1-20(2)8-16-14-18-12-11(13(23)19-14)17-9(7-15-12)5-6-10(22)21(3)24-4/h5-8H,1-4H3,(H,15,18,19,23)/b6-5+,16-8+
InChIKey FEJPHEKWAPJRNF-DUIRGAHLSA-N
Mol Weight 331.34 g/mol
Molecular Formula C14H17N7O3
Exact Mass 331.139287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 22uu1GZqOdb
Name 2-(N,N-DIMETHYLAMINOMETHYLENEAMINO)-6-[2-(N-METHOXY-N-METHYLCARBAMOYL)-VINYL]-PTERIDIN-4(3H)-ONE
Compound Number 4A
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Formula C14H17N7O3
InChI InChI=1S/C14H17N7O3/c1-20(2)8-16-14-18-12-11(13(23)19-14)17-9(7-15-12)5-6-10(22)21(3)24-4/h5-8H,1-4H3,(H,15,18,19,23)/b6-5+,16-8+
InChIKey FEJPHEKWAPJRNF-DUIRGAHLSA-N
Literature Reference Author C.L.GIBSON,A.LANG,K.OHTA,C.J.SUCKLING
Literature Reference Citation J.CHEM.SOC.PERKIN-1,163(1999)
Literature Reference DOI 10.1039/a807756h
Molecular Weight 331.334 g/mol
Solvent CDCl3