Table 2: Listing of 15N (400 MHz) NMR spectral data for 2 inDMSO-d6, including results obtained by heteronuclear single quantum coherence shift-correlated (HSQC) and heteronuclear multiple bond coherence shift-correlated (HMBC).

 

Position

Hδ

Nδ

Correlation

1H-15N

(NH) 1

7.02 (s)

93.29

H-1,N-1

5

1.24 (s)

93.29

H1,2,3-5, N-1

 

6

 

4.39, 4.83 (AB, 14)

93.29

H1,2-6, N-1

214.54

H1,2-6, N-7

299.12

H1,2-6, N-8

 

9

 

 

7.96 (s)

214.54

H3'triazole-9, N-7

251.97

H3'triazole-9, N-10

299.12

H3'triazole-9, N-8

11

 

8.20 (s)

214.54

H5'-triazole-11, N-7

251.97

H5'-triazole-11, N-10

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

Chemical shifts (δ, ppm) and coupling constants (J, Hz, in parenthesis) obtained of 1D 1H-NMR spectrum.

15N NMR spectrum of the compound 2 shows four signals corresponding to four nitrogen atoms and assigning each signal to its corresponding nitrogen atom is carried out based mainly on the spectral data 1H-15N HMBC (Figure 3).