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Details
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
D
74.20
73.5
2
S
87.60
83.9
3
S
79.17
87.48
5
T
39.00
34.58
6
T
25.44
23.78
7
D
49.50
49.83
8
D
39.40
39.11
9
T
27.32
26.35
10
T
29.52
29.4
11
S
137.70
138.0
12
D
113.89
112.36
13
S
157.74
160.89
15
Q
55.01
55.41
16
D
111.59
111.2
17
D
126.28
126.4
18
S
132.31
137.4
19
D
43.75
44.1
20
T
26.75
25.6
21
T
32.80
35.15
22
S
47.20
44.91
23
Q
18.42
16.63
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
D
73.50
74.2
2
S
83.90
87.6
3
S
87.48
79.17
5
T
34.58
39.0
6
T
23.78
25.44
7
D
49.83
49.5
8
D
39.11
39.4
9
T
26.35
27.32
10
T
29.40
29.52
11
S
138.00
137.7
12
D
112.36
113.89
13
S
160.89
157.74
15
Q
55.41
55.01
16
D
111.20
111.59
17
D
126.40
126.28
18
S
137.40
132.31
19
D
44.10
43.75
20
T
25.60
26.75
21
T
35.15
32.8
22
S
44.91
47.2
23
Q
16.63
18.42
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