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Details
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This molecule with other stereoconfigurations:
Type: 13C Unreported
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Atom |
Mult.(coupling const.) |
Meas. Shift |
| Prediction 0 acd_lotusv7 | Prediction 1 acd_lotusv7 | Prediction 2 hose_lotusv7 | Prediction 3 hose_lotusv7 |
1
|
S |
137.6 |
| 137.64 | 137.64 | 139.95 | 139.95 |
2
|
S |
153.3 |
| 153.29 | 153.29 | 153.41 | 153.41 |
3
|
D |
103.5 |
| 103.35 | 103.35 | 103.5 | 103.5 |
4
|
S |
133.3 |
| 130.1 | 129.7 | 133.3 | 133.3 |
5
|
D |
103.5 |
| 103.35 | 103.35 | 103.5 | 103.5 |
6
|
S |
153.3 |
| 153.29 | 153.29 | 153.41 | 153.41 |
7
|
D |
126.9 |
| 128.42 | 128.23 | 126.9 | 126.9 |
8
|
D |
127.7 |
| 127.69 | 130.24 | 127.7 | 127.7 |
9
|
S |
130.9 |
| 133.09 | 133.0 | 130.9 | 130.9 |
10
|
D |
119.1 |
| 119.13 | 119.13 | 119.0 | 119.0 |
11
|
D |
110.6 |
| 110.65 | 110.65 | 112.0 | 112.0 |
12
|
S |
146.4 |
| 148.47 | 148.56 | 147.3 | 147.3 |
13
|
S |
145.8 |
| 146.67 | 146.67 | 146.1 | 146.1 |
14
|
D |
111.7 |
| 111.73 | 111.73 | 112.0 | 112.0 |
16
|
Q |
60.8 |
| 60.85 | 60.85 | 60.1 | 60.1 |
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