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Details
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
Q
12.00
12.3
2
T
23.10
23.0
3
D
45.83
46.05
4
T
26.10
26.4
5
T
33.97
34.0
6
D
35.32
36.3
7
Q
18.83
18.8
8
D
51.40
57.23
9
T
28.74
29.4
10
T
27.52
24.9
11
D
50.94
51.8
12
D
38.66
38.52
13
D
81.43
73.99
16
D
119.92
126.95
17
S
148.84
146.0
18
T
42.20
41.8
19
D
71.41
71.2
21
T
31.36
31.6
22
T
36.31
37.5
23
S
38.46
36.5
24
Q
21.70
16.19
25
D
42.50
46.1
26
T
21.84
21.67
27
T
37.25
39.7
28
S
42.37
42.6
29
Q
20.73
12.0
30
D
29.17
28.95
31
Q
18.85
19.2
32
Q
20.00
19.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
12.30
12.0
2
T
23.00
23.1
3
D
46.05
45.83
4
T
26.40
26.1
5
T
34.00
33.97
6
D
36.30
35.32
7
Q
18.80
18.83
8
D
57.23
51.4
9
T
29.40
28.74
10
T
24.90
27.52
11
D
51.80
50.94
12
D
38.52
38.66
13
D
73.99
81.43
16
D
126.95
119.92
17
S
146.00
148.84
18
T
41.80
42.2
19
D
71.20
71.41
21
T
31.60
31.36
22
T
37.50
36.31
23
S
36.50
38.46
24
Q
16.19
21.7
25
D
46.10
42.5
26
T
21.67
21.84
27
T
39.70
37.25
28
S
42.60
42.37
29
Q
12.00
20.73
30
D
28.95
29.17
31
Q
19.20
18.85
32
Q
19.20
20.0
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