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Molecular FormulaC6H11N5O

Molecular Weight169.18444

InChIInChI=1S/C6H11N5O/c1-4-8-6(12-10-4)9-5(7)11(2)3/h1-3H3,(H2,7,8,9,10)

InChIKey XBMFQTXLRQBWLR-UHFFFAOYSA-N

SmilesN(C)(C)/C(=N/C1ON=C(C)N=1)/N



  •     Assign.     Shift(ppm)
    A *1 7. B *1 4.6 C 3.110 D 2.241
    Spectral Code: 1H NMR : 400 MHz in CDCl3



  •        ppm   Int.  Assign.
    175.16 384 1 165.94 492 2 157.88 326 3 37.26 1000 4 12.35 629 5
    Spectral Code: 13C NMR : in CDCl3

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