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This molecule without stereoconfiguration: This molecule with other stereoconfigurations:
Type: 1H Unreported Double click to get resizeable window!
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Atom |
Mult.(coupling const.) |
Meas. Shift |
4-H
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6-H
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2.90 |
8-H
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9-H
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10-H
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11-H
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5.10 |
12-H
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3.45 |
13-H
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3.12 |
14-H
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15-H
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4.60 |
19-H
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10.03 (H 29) |
21-H
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0.95 |
22-H
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1.0 |
23-H
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25-H
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5.35 (H 27), 6.05 (H 28) |
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Type: 13C Double click to get resizeable window!
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Atom |
Mult.(coupling const.) |
Prediction Shift |
| Prediction 0 hose_lotusv7 |
2
|
S |
169.50 |
| 171.6 |
3
|
S |
56.70 |
| 54.4 |
4
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D |
43.64 |
| 44.2 |
5
|
S |
42.70 |
| 40.51 |
6
|
D |
62.92 |
| 40.7 |
7
|
S |
40.30 |
| 33.86 |
8
|
T |
41.82 |
| 35.1 |
9
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T |
18.60 |
| 22.98 |
10
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T |
30.93 |
| 35.15 |
11
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T |
70.79 |
| 71.91 |
12
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T |
34.81 |
| 34.4 |
13
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D |
35.20 |
| 35.1 |
14
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T |
42.00 |
| 42.3 |
15
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D |
65.23 |
| 65.6 |
16
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S |
200.70 |
| 200.0 |
17
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S |
150.60 |
| 151.4 |
19
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D |
204.23 |
| 202.02 |
21
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Q |
28.45 |
| 26.85 |
22
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Q |
27.57 |
| 26.85 |
25
|
T |
117.10 |
| 118.16 |
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Double click upper part to get resizeable window!
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Type: 13C Double click to get resizeable window!
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| Prediction 0 acd_lotusv7 |
2
|
S |
171.60 |
| 169.5 |
3
|
S |
54.40 |
| 56.7 |
4
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D |
44.20 |
| 43.64 |
5
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S |
40.51 |
| 42.7 |
6
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D |
40.70 |
| 62.92 |
7
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S |
33.86 |
| 40.3 |
8
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D |
35.10 |
| 41.82 |
9
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T |
22.98 |
| 18.6 |
10
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T |
35.15 |
| 30.93 |
11
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T |
71.91 |
| 70.79 |
12
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T |
34.40 |
| 34.81 |
13
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D |
35.10 |
| 35.2 |
14
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T |
42.30 |
| 42.0 |
15
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D |
65.60 |
| 65.23 |
16
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S |
200.00 |
| 200.7 |
17
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S |
151.40 |
| 150.6 |
19
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D |
202.02 |
| 204.23 |
21
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Q |
26.85 |
| 28.45 |
22
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Q |
26.85 |
| 27.57 |
25
|
T |
118.16 |
| 117.1 |
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