|
Search Results
|
|
|
|
You did not do a search!
|
|
|
|
|
|
|
|
Bookmarks
|
|
|
|
You could bookmark structures if you were logged in!
|
|
|
|
|
|
|
Details
|
|
|
|
This molecule with other stereoconfigurations:
Type: 13C Unreported
|
|
Atom |
Mult.(coupling const.) |
Meas. Shift |
| expt-0 dkfz spektren database | Prediction 1 acd_lotusv7 | Prediction 2 acd_lotusv7 | Prediction 3 hose_lotusv7 | Prediction 4 hose_lotusv7 |
1
|
S |
134.1 |
| 134.1 | 134.47 | 134.47 | 134.1 | 134.1 |
2
|
D |
129.0 |
| 128.5 | 128.93 | 128.93 | 128.79 | 128.79 |
3
|
D |
128.5 |
| 129.0 | 129.1 | 129.1 | 128.71 | 128.71 |
4
|
D |
131.0 |
| 131.1 | 130.97 | 130.97 | 128.45 | 128.45 |
5
|
D |
128.5 |
| 129.0 | 129.1 | 129.1 | 128.71 | 128.71 |
6
|
D |
129.0 |
| 128.5 | 128.93 | 128.93 | 128.79 | 128.79 |
7
|
D |
152.5 |
| 152.5 | 152.62 | 152.62 | 152.5 | 152.5 |
8
|
D |
128.2 |
| 128.2 | 129.31 | 129.31 | 128.2 | 128.2 |
9
|
D |
193.5 |
| 193.5 | 193.57 | 193.57 | 193.44 | 193.44 |
|
|
Type: 13C 23
|
|
Atom |
Mult.(coupling const.) |
Meas. Shift |
Intensity |
| expt-0
| Prediction 1 acd_lotusv7 | Prediction 2 acd_lotusv7 | Prediction 3 hose_lotusv7 | Prediction 4 hose_lotusv7 |
1
|
S |
134.1 |
0.119 |
| 134.1 | 134.47 | 134.47 | 134.1 | 134.1 |
2
|
D |
128.5 |
1.0 |
| 129.0 | 128.93 | 128.93 | 128.79 | 128.79 |
3
|
D |
129.0 |
0.681 |
| 128.5 | 129.1 | 129.1 | 128.71 | 128.71 |
4
|
D |
131.1 |
0.246 |
| 131.0 | 130.97 | 130.97 | 128.45 | 128.45 |
5
|
D |
129.0 |
0.681 |
| 128.5 | 129.1 | 129.1 | 128.71 | 128.71 |
6
|
D |
128.5 |
1.0 |
| 129.0 | 128.93 | 128.93 | 128.79 | 128.79 |
7
|
D |
152.5 |
0.263 |
| 152.5 | 152.62 | 152.62 | 152.5 | 152.5 |
8
|
D |
128.2 |
0.079 |
| 128.2 | 129.31 | 129.31 | 128.2 | 128.2 |
9
|
D |
193.5 |
0.231 |
| 193.5 | 193.57 | 193.57 | 193.44 | 193.44 |
|
|
Report incorrect data
Copy molecule link
|
|
|
|
|
|
|
|