Table 1.
no. | δC, type | δH (J) | COSY | HMBC or CIGAR |
---|---|---|---|---|
1 | 173.8,C | |||
2 | 39.0,CH2 | 2.46, dd (15.4, 3.8) 2.37, dd (15.3, 8.6) |
1, 3, 4 | |
3 | 68.0,CH | 3.99, dt (8.6, 3.8) | 2, 4 | 1, 2c, 5 |
4 | 75.7,CH | 3.93, dd (6.3, 3.8) | 2, 3, 6, 7, 8c | |
5 | 77.7,CH | 4.77, p (6.3) | 4, 6 | 3, 4c, 7 |
6 | 20.5,CH3 | 1.38, d (6.3) | 4, 5 | |
7 | 163.4,C | |||
8 | 111.7,C | |||
9 | 158.2,C | |||
10 | 118.5,CH | 7.02, d (8.8) | 11 | 7w, 8, 9, 12, 13w |
11 | 133.2,CH | 7.47, dd (8.8, 2.7) | 8w, 9, 12, 13 | |
12 | 122.2,C | |||
13 | 126.6,CH | 7.53, d (2.7) | 11w | 7, 9, 10c, 11, 12 |
NH | −170.4a | 12.28, brs |
Nitrogen chemical shift from 1H−15N HMBC
15N referenced to MeNO2 (IUPAC std). Referenced to NH3 it resonates at 210.1 ppm
CIGAR only
Weak correlations