pyrazin-2(1H)-one, sodium salt (24387-68-6) ¹H NMR

Product Namepyrazin-2(1H)-one, sodium salt

CAS 24387-68-6

Molecular FormulaC4H4N2NaO

Molecular Weight119.07713

InChIInChI=1S/C4H4N2O.Na/c7-4-3-5-1-2-6-4;/h1-3H,(H,6,7);/q;+1/p-1

InChIKey PXEGUCRXJYLKLJ-UHFFFAOYSA-M

Smiles[Na+].C1(=O)[N-]C=CN=C1

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¹HNMR

    Parameter     ppm  Hz

      D(A)         7.725
      D(B)         7.410
      D(C)         7.769
       J(A,B)         -0.08
       J(A,C)          1.41
       J(B,C)          2.99
     
     COX,R.H. & BOTHNER-BY,A.A. J.PHYS.CHEM. 73, 2465 (1969)

Spectral Code: 1H NMR : parameter in D2O

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pyrazin-2(1H)-one, sodium salt (24387-68-6) 1H NMR

pyrazin-2(1H)-one, sodium salt (24387-68-6) ¹H NMR