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This molecule with other stereoconfigurations:
Type: 13C 125
|
|
Atom |
Mult.(coupling const.) |
Meas. Shift |
| expt-0 chemie koeln | expt-1 chemie koeln |
1
|
|
97.42 |
| 98.82 | 97.47 |
2
|
|
75.77 |
| 77.22 | 77.1 |
3
|
|
79.51 |
| 82.5 | 81.14 |
4
|
|
76.20 |
| 76.29 | 76.47 |
5
|
|
69.82 |
| 76.04 | 71.19 |
6
|
|
71.04 |
| 71.63 | 71.85 |
7
|
|
54.88 |
| 53.47 | 54.86 |
8
|
|
58.22 |
| 58.31 | 59.25 |
9
|
|
56.75 |
| 56.77 | 57.58 |
10
|
|
60.07 |
| 59.56 | 60.77 |
11
|
|
58.33 |
| 58.27 | 59.41 |
|
|
Type: 1H 500.1300048828125
|
|
Atom |
Mult.(coupling const.) |
Meas. Shift |
| expt-0 chemie koeln | expt-1 chemie koeln |
1-H
|
|
4.84 |
| 4.81 | 4.59 |
2-H
|
|
3.73 |
| 3.56 | 3.44 |
3-H
|
|
3.50 |
| 3.5 | 3.41 |
4-H
|
|
3.28 |
| 3.43 | 3.38 |
5-H
|
|
3.61 |
| 3.58 | 3.4 |
6-H
|
|
3.63, 3.58 |
| 3.61 | 3.55 |
7-H
|
|
3.33 |
| 3.38 | 3.28 |
8-H
|
|
3.38 |
| 3.48 | 3.42 |
9-H
|
|
3.39 |
| 3.5 | 3.4 |
10-H
|
|
3.42 |
| 3.53 | 3.45 |
11-H
|
|
3.33 |
| 3.41 | 3.34 |
|
Show spectrum in full size
|
H,H-COSY Spectrum | 60003305
Rating: 10 |
Type: H,C-HSQC 500.1300048828125
|
|
Axis: 1 (H) |
Axis: 2 (C) |
Atom |
Shift |
Shift |
|
4
|
3.28 |
76.2 |
11
|
3.33 |
58.33 |
7
|
3.33 |
54.88 |
8
|
3.38 |
58.22 |
9
|
3.39 |
56.75 |
10
|
3.42 |
60.07 |
3
|
3.5 |
79.51 |
6
|
3.58 |
71.04 |
5
|
3.61 |
69.82 |
6
|
3.63 |
71.04 |
2
|
3.73 |
75.77 |
1
|
4.84 |
97.42 |
|
Show spectrum in full size
|
Type: H,C-HMBC 500.1300048828125
|
|
Axis: 1 (H) |
Axis: 2 (C) |
Atom |
Shift |
Atom |
Shift |
|
4
|
3.28 |
10
|
60.07 |
4
|
3.28 |
5
|
69.82 |
4
|
3.28 |
6
|
71.04 |
4
|
3.28 |
3
|
79.51 |
7
|
3.33 |
1
|
97.42 |
11
|
3.33 |
6
|
71.04 |
8
|
3.38 |
2
|
75.77 |
9
|
3.39 |
3
|
79.51 |
10
|
3.42 |
4
|
76.2 |
3
|
3.5 |
9
|
56.75 |
3
|
3.5 |
4
|
76.2 |
3
|
3.5 |
2
|
75.77 |
6
|
3.58 |
11
|
58.33 |
5
|
3.61 |
4
|
76.2 |
6
|
3.63 |
11
|
58.33 |
6
|
3.63 |
3
|
79.51 |
6
|
3.63 |
4
|
76.2 |
2
|
3.73 |
3
|
79.51 |
2
|
3.73 |
8
|
58.22 |
1
|
4.84 |
7
|
54.88 |
1
|
4.84 |
5
|
69.82 |
1
|
4.84 |
3
|
79.51 |
1
|
4.84 |
2
|
75.77 |
|
Show spectrum in full size
|
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