alpha-carboline(244-76-8) ¹H NMR

Product Namealpha-carboline

CAS 244-76-8

Molecular FormulaC11H8N2

Molecular Weight168.19

InChIInChI=1S/C11H8N2/c1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10/h1-7H,(H,12,13)

InChIKey BPMFPOGUJAAYHL-UHFFFAOYSA-N

SmilesN1C2=C(C=CC=C2)C2=CC=CN=C12

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¹HNMR

    Parameter     ppm  Hz

      D(A)         8.434
      D(B)         7.203
      D(C)         8.490
       J(A,B)          4.85
       J(A,C)          1.69
       J(B,C)          7.69
     
      D(D)         8.163
      D(E)         7.236
      D(F)         7.471
      D(G)         7.538
       J(D,E)          7.86
       J(D,F)          1.18
       J(D,G)          0.77
       J(E,F)          7.23
       J(E,G)          0.99
       J(F,G)          8.18
     
      D(H)        11.78
     
     BALKAU,F. & HEFFERNAN,M.L. AUST.J.CHEM. 26, 1501 (1973)
     H(C),H(D) & H(H):BROAD. J(C,H) & J(D,H):NOT RESOLVED.

Spectral Code: 1H NMR : parameter in DMSO-d6

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