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Details
This molecule with some stereoconfiguration:
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
Q
59.90
60.7
3
S
139.07
149.4
4
S
125.20
124.18
5
S
120.51
126.2
6
S
110.05
120.89
7
S
142.99
147.18
8
S
139.71
135.69
10
T
101.17
101.51
12
S
118.50
137.31
13
D
127.76
127.97
14
D
114.68
114.67
15
S
157.90
155.25
17
D
111.25
111.37
18
S
141.58
142.79
19
S
72.75
75.9
20
Q
33.53
26.53
22
S
170.64
155.79
24
T
45.94
48.59
25
T
19.84
24.91
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
60.70
59.9
3
S
149.40
139.07
4
S
124.18
125.2
5
S
126.20
120.51
6
S
120.89
110.05
7
S
147.18
142.99
8
S
135.69
139.71
10
T
101.51
101.17
12
S
137.31
118.5
13
D
127.97
127.76
14
D
114.67
114.68
15
S
155.25
157.9
17
D
111.37
111.25
18
S
142.79
141.58
19
S
75.90
72.75
20
Q
26.53
33.53
22
S
155.79
170.64
24
T
48.59
45.94
25
T
24.91
19.84
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