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Details
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
Q
56.30
55.3
3
D
99.51
96.41
5
S
97.59
97.76
7
D
73.78
73.06
9
S
170.14
170.18
10
Q
21.04
21.08
12
T
62.39
66.77
14
D
106.17
111.2
16
D
96.06
80.35
17
D
49.95
52.47
18
S
131.71
144.39
19
D
127.32
128.23
20
T
31.41
24.34
21
D
43.88
45.0
22
S
138.70
158.51
23
S
140.60
136.4
24
D
28.30
27.3
25
Q
22.05
21.8
26
Q
22.05
21.8
27
T
29.20
29.1
28
T
39.60
38.0
29
S
49.60
49.6
30
Q
25.00
24.3
31
T
37.60
35.7
32
T
28.07
35.15
33
S
41.49
41.97
34
Q
17.82
18.0
35
S
79.33
84.92
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
55.30
56.3
3
D
96.41
99.51
5
S
97.76
97.59
7
D
73.06
73.78
9
S
170.18
170.14
10
Q
21.08
21.04
12
T
66.77
62.39
14
D
111.20
106.17
16
D
80.35
96.06
17
D
52.47
49.95
18
S
144.39
131.71
19
D
128.23
127.32
20
T
24.34
31.41
21
D
45.00
43.88
22
S
158.51
138.7
23
S
136.40
140.6
24
D
27.30
28.3
25
Q
21.80
22.05
26
Q
21.80
22.05
27
T
29.10
29.2
28
T
38.00
39.6
29
S
49.60
49.6
30
Q
24.30
25.0
31
T
35.70
37.6
32
T
35.15
28.07
33
S
41.97
41.49
34
Q
18.00
17.82
35
S
84.92
79.33
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