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Details
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
T
108.90
110.55
2
S
149.70
147.42
3
Q
20.60
20.65
4
D
43.41
30.7
5
Q
18.80
18.8
6
D
130.61
140.02
7
D
135.18
134.1
8
D
36.30
40.62
9
Q
20.34
20.26
10
D
51.29
56.0
11
T
28.52
26.44
12
T
27.47
24.95
13
D
53.66
56.9
14
D
34.09
31.95
15
T
31.75
32.18
16
D
122.68
121.43
17
S
138.91
156.04
18
T
48.57
41.83
19
S
208.84
207.22
21
T
37.20
38.11
22
T
36.83
35.75
23
S
37.40
36.5
24
Q
23.39
16.19
25
D
48.85
50.37
26
T
22.05
21.2
27
T
37.41
41.46
28
S
42.13
43.34
29
Q
20.92
16.07
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
T
110.55
108.9
2
S
147.42
149.7
3
Q
20.65
20.6
4
D
30.70
43.41
5
Q
18.80
18.8
6
D
140.02
130.61
7
D
134.10
135.18
8
D
40.62
36.3
9
Q
20.26
20.34
10
D
56.00
51.29
11
T
26.44
28.52
12
T
24.95
27.47
13
D
56.90
53.66
14
D
31.95
34.09
15
T
32.18
31.75
16
D
121.43
122.68
17
S
156.04
138.91
18
T
41.83
48.57
19
S
207.22
208.84
21
T
38.11
37.2
22
T
35.75
36.83
23
S
36.50
37.4
24
Q
16.19
23.39
25
D
50.37
48.85
26
T
21.20
22.05
27
T
41.46
37.41
28
S
43.34
42.13
29
Q
16.07
20.92
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