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Details
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
Q
17.20
17.2
2
D
30.49
30.45
3
T
29.94
28.8
4
T
33.32
33.05
5
S
107.12
107.74
6
T
37.48
36.4
7
D
54.63
51.79
8
D
87.45
79.17
10
D
73.20
78.17
12
D
59.64
55.55
13
D
36.58
42.23
14
T
32.72
29.23
15
T
28.94
28.45
16
D
46.30
43.7
17
T
37.20
37.91
18
D
76.15
71.23
20
T
31.30
31.48
21
T
36.67
36.39
22
S
35.55
35.7
23
Q
16.83
11.99
24
D
54.49
50.86
25
T
22.25
21.64
26
T
35.13
35.15
27
S
40.33
44.23
28
Q
18.67
16.59
30
T
67.31
66.9
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
17.20
17.2
2
D
30.45
30.49
3
T
28.80
29.94
4
T
33.05
33.32
5
S
107.74
107.12
6
T
36.40
37.48
7
D
51.79
54.63
8
D
79.17
87.45
10
D
78.17
73.2
12
D
55.55
59.64
13
D
42.23
36.58
14
T
29.23
32.72
15
T
28.45
28.94
16
D
43.70
46.3
17
T
37.91
37.2
18
D
71.23
76.15
20
T
31.48
31.3
21
T
36.39
36.67
22
S
35.70
35.55
23
Q
11.99
16.83
24
D
50.86
54.49
25
T
21.64
22.25
26
T
35.15
35.13
27
S
44.23
40.33
28
Q
16.59
18.67
30
T
66.90
67.31
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