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Details
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Type: 13C 23
|
|
Atom |
Mult.(coupling const.) |
Meas. Shift |
Intensity |
| Prediction 0 acd_lotusv7 | Prediction 1 hose_lotusv7 |
1
|
T |
60.6 |
0.474 |
| 60.29 | 60.6 |
2
|
T |
41.9 |
0.474 |
| 41.47 | 41.9 |
3
|
D |
25.0 |
0.427 |
| 24.61 | 25.0 |
4
|
Q |
22.7 |
1.0 |
| 22.33 | 22.7 |
5
|
Q |
22.7 |
1.0 |
| 22.33 | 22.7 |
|
|
Type: 13C
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| expt-0 dkfz spektren database | Prediction 1 hose_lotusv7 |
1
|
T |
60.29 |
| 60.6 | 60.6 |
2
|
T |
41.47 |
| 41.9 | 41.9 |
3
|
D |
24.61 |
| 25.0 | 25.0 |
4
|
Q |
22.33 |
| 22.7 | 22.7 |
5
|
Q |
22.33 |
| 22.7 | 22.7 |
|
|
Type: 13C
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| expt-0 dkfz spektren database | Prediction 1 acd_lotusv7 |
1
|
T |
60.6 |
| 60.6 | 60.29 |
2
|
T |
41.9 |
| 41.9 | 41.47 |
3
|
D |
25.0 |
| 25.0 | 24.61 |
4
|
Q |
22.7 |
| 22.7 | 22.33 |
5
|
Q |
22.7 |
| 22.7 | 22.33 |
|
|
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