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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
Q
55.21
56.57
3
S
159.49
161.1
4
D
114.08
115.0
5
D
127.88
128.5
6
S
131.74
136.23
7
D
75.70
80.4
9
S
169.78
170.84
10
Q
21.24
21.1
12
D
48.05
54.4
13
T
69.05
71.3
15
D
82.70
82.0
16
S
132.62
136.23
17
D
128.27
127.4
18
D
116.10
116.2
19
S
157.70
158.0
21
D
116.10
116.2
22
D
128.27
127.4
23
D
46.90
54.4
24
T
62.54
63.7
26
S
170.60
171.06
27
Q
20.80
20.96
29
D
127.88
128.5
30
D
114.08
115.0
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
56.57
55.21
3
S
161.10
159.49
4
D
115.00
114.08
5
D
128.50
127.88
6
S
136.23
131.74
7
D
80.40
75.7
9
S
170.84
169.78
10
Q
21.10
21.24
12
D
54.40
48.05
13
T
71.30
69.05
15
D
82.00
82.7
16
S
136.23
132.62
17
D
127.40
128.27
18
D
116.20
116.1
19
S
158.00
157.7
21
D
116.20
116.1
22
D
127.40
128.27
23
D
54.40
46.9
24
T
63.70
62.54
26
S
171.06
170.6
27
Q
20.96
20.8
29
D
128.50
127.88
30
D
115.00
114.08
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