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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
24.45
23.63
2
S
141.42
140.47
3
D
119.07
133.77
4
S
156.15
135.88
5
D
122.60
125.31
6
S
196.19
197.0
8
S
121.24
119.45
9
D
115.41
115.38
10
S
147.26
148.13
12
D
123.30
121.7
13
D
119.43
119.07
14
S
156.95
160.61
16
T
33.03
23.69
17
T
23.04
22.98
18
T
31.60
30.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
23.63
24.45
2
S
140.47
141.42
3
D
133.77
119.07
4
S
135.88
156.15
5
D
125.31
122.6
6
S
197.00
196.19
8
S
119.45
121.24
9
D
115.38
115.41
10
S
148.13
147.26
12
D
121.70
123.3
13
D
119.07
119.43
14
S
160.61
156.95
16
T
23.69
33.03
17
T
22.98
23.04
18
T
30.20
31.6
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