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Details
This molecule with other stereoconfigurations:
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
Q
14.42
14.34
2
T
20.79
20.71
3
D
132.19
133.49
4
D
127.26
128.32
5
T
25.55
25.65
6
D
128.34
128.05
7
D
128.36
128.05
8
T
25.80
26.2
9
D
129.85
128.32
10
D
128.40
130.77
11
T
33.78
38.7
12
S
143.54
137.25
13
D
106.94
108.6
14
S
158.68
159.9
16
D
102.00
101.0
17
S
158.68
159.9
19
D
106.94
108.6
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
14.34
14.42
2
T
20.71
20.79
3
D
133.49
132.19
4
D
128.32
127.26
5
T
25.65
25.55
6
D
128.05
128.34
7
D
128.05
128.36
8
T
26.20
25.8
9
D
128.32
129.85
10
D
130.77
128.4
11
T
38.70
33.78
12
S
137.25
143.54
13
D
108.60
106.94
14
S
159.90
158.68
16
D
101.00
102.0
17
S
159.90
158.68
19
D
108.60
106.94
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