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Details
Spectral Data
Additional Data
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Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
T
111.66
111.75
2
D
145.73
145.17
3
S
73.02
73.74
4
Q
27.58
28.63
6
T
43.06
38.34
7
T
28.31
30.7
8
S
138.54
135.43
9
D
125.10
127.98
10
S
143.61
152.6
11
S
131.40
141.2
12
S
134.86
134.91
13
Q
16.49
16.47
14
S
132.73
135.89
15
Q
14.01
16.7
16
T
28.90
28.5
17
T
19.80
19.1
18
T
43.40
37.7
19
S
33.80
34.9
20
Q
30.49
31.9
21
Q
32.49
31.9
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
T
111.75
111.66
2
D
145.17
145.73
3
S
73.74
73.02
4
Q
28.63
27.58
6
T
38.34
43.06
7
T
30.70
28.31
8
S
135.43
138.54
9
D
127.98
125.1
10
S
152.60
143.61
11
S
141.20
131.4
12
S
134.91
134.86
13
Q
16.47
16.49
14
S
135.89
132.73
15
Q
16.70
14.01
16
T
28.50
28.9
17
T
19.10
19.8
18
T
37.70
43.4
19
S
34.90
33.8
20
Q
31.90
30.49
21
Q
31.90
32.49
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