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Details
General
acd_lotusv7/
hose_lotusv7/
Spectral Data
Additional Data
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Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
Prediction 0
acd_lotusv7
Prediction 1
acd_lotusv7
Prediction 2
hose_lotusv7
Prediction 3
hose_lotusv7
1
S
142.7
142.69
142.69
142.7
142.7
2
S
154.5
154.13
154.13
154.5
154.5
3
D
101.6
101.57
101.38
101.6
101.6
4
S
137.0
136.09
136.09
137.0
137.0
5
S
155.7
154.96
154.96
155.7
155.7
6
S
122.2
111.91
111.91
122.2
122.2
7
S
181.9
181.64
181.64
181.9
181.9
8
S
156.2
157.12
157.12
156.2
156.2
9
S
103.7
103.2
102.76
103.7
103.7
10
D
94.1
95.36
95.36
94.19
94.19
11
S
157.9
157.83
157.83
157.9
157.9
12
S
159.8
161.08
161.08
159.21
159.21
13
S
104.5
104.46
104.46
104.48
104.48
14
S
77.9
78.27
78.27
77.98
77.98
15
D
127.1
127.41
127.41
127.7
127.7
16
D
115.7
115.52
115.52
115.73
115.73
17
Q
28.3
27.51
27.51
28.28
28.28
18
Q
28.3
29.51
29.51
28.28
28.28
19
Q
62.0
62.05
61.92
62.0
62.0
20
T
26.5
26.6
26.84
26.5
26.5
21
D
123.2
123.8
122.98
123.2
123.2
22
S
135.6
137.15
137.63
135.6
135.6
23
T
39.7
36.02
40.09
39.6
39.6
24
Q
16.5
18.4
16.51
16.3
16.3
25
T
26.4
24.36
24.63
26.25
26.25
26
D
124.2
125.26
124.5
124.03
124.03
27
S
131.2
131.99
131.99
130.53
130.53
28
Q
25.6
19.94
20.04
17.45
17.45
29
Q
17.6
19.86
19.95
25.32
25.32
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