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. 2017 May 17;13:925–937. doi: 10.3762/bjoc.13.94

Table 3.

Experimental and calculated 1H NMR data for the compound 1 in different solvents. The chemical shifts values are given in ppm and the 3JHH coupling constants in Hz.

graphic file with name Beilstein_J_Org_Chem-13-925-i002.jpg

solvent ε δHa δHb1 δΗb2 3JHaHb1,obs 3JHaHb1,calc 3JHaHb2,obs 3JHaHb2,calc

CDCl3 4.8 4.00 2.24 2.17 5.1 ± 0.05 4.6 7.1 ± 0.05 7.5
CD2Cl2 9.1 3.97 2.22 2.14 5.2 ± 0.05 4.8 7.0 ± 0.05 7.3
CD3CN 37.5 3.84 2.09 2.09 6.1 ± 0.05 4.7 6.1 ± 0.05 7.4
DMSO-d6 46.7 3.55 1.89 1.78 5.6 ± 0.05 4.7 7.4 ± 0.05 7.4