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. 1999 Apr;65(4):1405–1412. doi: 10.1128/aem.65.4.1405-1412.1999

TABLE 3.

1H and 13C NMR data for 2-amino-5-chlorophenol and 5-chloropicolinic acid in CD3OD

2-Amino-5-chlorophenol
5-Chloropicolinic acid
1H chemical shifts (ppm) 1H-1H coupling constants (Hz) 13C chemical shifts (ppm) 1H chemical shifts (ppm) 1H-1H coupling constants (Hz) 13C chemical shifts (ppm) One-bond 13C-1H coupling constants (Hz)a
H-3 6.70 (3-4) 8.3 C-1 147.2 H-3 8.18 (3-4) 8.4 C-2 147.6
H-4 6.64 (4-6) 2.3 C-2 135.5 H-4 8.08 (3-6) 0.7 C-3 127.3 168.0
H-6 6.72 C-3 117.6 H-6 8.70 (4-6) 2.4 C-4 138.7 170.5
C-4 120.5 C-5 137.1
C-5 123.8 C-6 149.4 186.3
C-6 115.4 C-7 166.6
a

The values of the one-bond 13C-1H coupling constants were estimated from the residual cross peaks in the 1H-detected long-range 13C-1H correlation.