Position of Proton | 1H NMR Data (in D2O) | ||
---|---|---|---|
Major Constituent (M-11b) | Minor Constituent (M-11a) | ||
1 | 2.18a (3Hb, sc) | 2.11a (3Hb, sc) | |
2 | 2.82 (2H, m) | 2.79 (2H, m) | |
3 | 3.45 (2H, m) | 3.41 (2H, m) | |
5 | 5.26 (1H, s) | 5.43-5.47d (1H, d, J = 8.1e) | |
6 | 5.33 (1H, s) | 5.43-5.47d (1H, d, J = 8.1e) | |
8, 9, and 10 | 7.39-7.49 (10H, m) | 7.40-7.48 (10H, m) | |
13 | 8.45 (1.3H, s) | 8.45 (2H, s) |
Position of Carbon | 13C-NMR Data (in D2O)xc | ||
---|---|---|---|
Major Constituent (M-11b) | Minor Constituent (M-11a) | ||
1 | 14.61a | 14.48a | |
2 | 39.04 | 38.49 | |
3 | 43.49 | 42.90 | |
4 | 61.95-61.99f | 61.95-61.99f | |
5 | 87.61 | 80.22 or 85.78f | |
6 | 93.10 | 80.22 or 85.78f | |
7 | 144.2-144.4f | 144.2-144.4f | |
8, 9, and 10 | 130.7-131.8f | 130.7-131.8f | |
11 | 170.8 | 169.5 | |
12 | 181.9-182.2f | 181.9-182.2f | |
13 | 173.8 | 173.8 |
↵ a Chemical shifts are reported in parts per million.
↵ b Intensities are represented as number of protons.
↵ c Multiplicity: s, singlet; d, doublet; m, multiplet.
↵ d These proton signals could not be distinguished.
↵ e Coupling constants (J) are given in Hertz.
↵ f These carbon signals could not be distinguished.