Table 1.
position | δ C | δ H | HMBCa |
---|---|---|---|
1 | 91.7 CH | 5.87, d (1.3) | 3, 4a, CO |
3 | 140.5 CH | 6.55, s | 1, 4, 4a, 12, |
4 | 116.1 qC | ||
4a | 36.7 CH | 2.19, dd (8, 12) | 3, 4, 5, 11 |
5 | 30.5 CH2 | 1.50, m 1.90, m | 4a, 6 |
6 | 40.2 CH2 | 2.10, m 2.22, m | 5, 7, 8 |
7 | 135.7 qC | ||
8 | 124.3 CH | 5.40, t (5.9) | 9 |
9 | 25.1 CH2 | 2.50, m 2.10, m | 8, 10 |
10 | 35.4 CH2 | 2.27, m | 11, 19 |
11 | 151.3 qC | ||
11a | 49.9 CH | 1.99, dd (1.3,12) | 1, 4a, 11 |
12 | 72.4 CH | 5.54, t (6.2) | 3, 4, 4a, 13, 14, CO |
13 | 32.7 CH2 | 1.96, m | 12, 14 |
14 | 60.9 CH | 2.73, t (5.9) | 13 |
15 | 58.0 qC | ||
16 | 19.0 CH3 | 1.29, s | 14, 15, 17 |
17 | 24.6 CH3 | 1.29, s | 14, 15, 16 |
18 | 17.7 CH3 | 1.66, s | 6, 7, 8 |
19 | 113.1 CH2 | 4.78, s 4.87, s | 10, 11, 11a, |
CH3 of CH3COO |
21.3 CH3 | 2.06, s | CO |
CO of CH3COO |
169.6 qC | ||
CH3 of CH3COO |
21.3 CH3 | 2.04, s | CO |
CO of CH3COO |
170.4 qC |
HMBC correlations, optimized for 8 Hz, are from proton(s) stated to the indicated carbon.