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Details
This molecule without stereoconfiguration:
This molecule with other stereoconfigurations:
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
Q
55.34
55.95
3
S
147.29
148.97
4
D
110.54
110.48
5
S
126.28
132.4
6
S
126.28
125.9
7
D
109.12
109.0
8
S
146.99
146.8
10
Q
55.34
55.47
11
T
58.23
57.58
13
T
51.00
51.35
14
T
27.80
28.7
15
S
125.70
126.57
16
D
111.10
109.33
17
S
147.70
147.21
19
Q
55.70
55.95
20
S
147.20
147.3
22
Q
55.20
55.78
23
D
108.80
110.27
24
S
128.36
129.6
25
D
59.30
59.2
26
T
36.35
36.7
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
55.95
55.34
3
S
148.97
147.29
4
D
110.48
110.54
5
S
132.40
126.28
6
S
125.90
126.28
7
D
109.00
109.12
8
S
146.80
146.99
10
Q
55.47
55.34
11
T
57.58
58.23
13
T
51.35
51.0
14
T
28.70
27.8
15
S
126.57
125.7
16
D
109.33
111.1
17
S
147.21
147.7
19
Q
55.95
55.7
20
S
147.30
147.2
22
Q
55.78
55.2
23
D
110.27
108.8
24
S
129.60
128.36
25
D
59.20
59.3
26
T
36.70
36.35
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