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Details
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Type: 13C
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| Prediction 0 hose_lotusv7 |
1
|
Q |
55.87 |
| 55.7 |
3
|
S |
147.75 |
| 148.87 |
4
|
D |
110.70 |
| 111.81 |
5
|
S |
125.55 |
| 127.51 |
6
|
D |
145.13 |
| 145.7 |
7
|
D |
113.88 |
| 114.7 |
8
|
S |
166.68 |
| 166.3 |
11
|
T |
63.40 |
| 62.9 |
12
|
D |
76.38 |
| 73.6 |
14
|
D |
107.49 |
| 104.6 |
16
|
D |
81.62 |
| 79.13 |
17
|
D |
98.95 |
| 100.49 |
19
|
S |
164.59 |
| 162.63 |
20
|
D |
100.02 |
| 99.08 |
21
|
S |
161.57 |
| 163.6 |
23
|
S |
106.25 |
| 105.44 |
24
|
S |
177.60 |
| 180.1 |
26
|
S |
133.80 |
| 135.8 |
28
|
D |
102.46 |
| 102.6 |
30
|
D |
77.82 |
| 79.2 |
31
|
T |
61.82 |
| 60.8 |
33
|
D |
70.68 |
| 72.0 |
35
|
D |
77.24 |
| 75.5 |
37
|
D |
75.01 |
| 73.9 |
39
|
S |
156.00 |
| 162.0 |
40
|
S |
120.90 |
| 121.11 |
41
|
D |
131.56 |
| 130.94 |
42
|
D |
115.72 |
| 115.18 |
43
|
S |
160.00 |
| 160.12 |
45
|
D |
115.72 |
| 115.18 |
46
|
D |
131.56 |
| 130.94 |
48
|
S |
157.10 |
| 155.94 |
49
|
D |
95.20 |
| 94.42 |
51
|
D |
70.61 |
| 70.25 |
52
|
Q |
18.25 |
| 18.16 |
53
|
D |
74.15 |
| 71.7 |
55
|
D |
72.49 |
| 69.4 |
57
|
D |
75.63 |
| 74.1 |
59
|
D |
76.41 |
| 75.9 |
61
|
D |
70.90 |
| 70.2 |
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| Prediction 0 hose_lotusv7 |
63
|
D |
122.64 |
| 123.82 |
64
|
D |
115.25 |
| 115.45 |
65
|
S |
149.15 |
| 149.24 |
|
|
Type: 13C
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| Prediction 0 acd_lotusv7 |
1
|
Q |
55.70 |
| 55.87 |
3
|
S |
148.87 |
| 147.75 |
4
|
D |
111.81 |
| 110.7 |
5
|
S |
127.51 |
| 125.55 |
6
|
D |
145.70 |
| 145.13 |
7
|
D |
114.70 |
| 113.88 |
8
|
S |
166.30 |
| 166.68 |
11
|
T |
62.90 |
| 63.4 |
12
|
D |
73.60 |
| 76.38 |
14
|
D |
104.60 |
| 107.49 |
16
|
D |
79.13 |
| 81.62 |
17
|
D |
100.49 |
| 98.95 |
19
|
S |
162.63 |
| 164.59 |
20
|
D |
99.08 |
| 100.02 |
21
|
S |
163.60 |
| 161.57 |
23
|
S |
105.44 |
| 106.25 |
24
|
S |
180.10 |
| 177.6 |
26
|
S |
135.80 |
| 133.8 |
28
|
D |
102.60 |
| 102.46 |
30
|
D |
79.20 |
| 77.82 |
31
|
T |
60.80 |
| 61.82 |
33
|
D |
72.00 |
| 70.68 |
35
|
D |
75.50 |
| 77.24 |
37
|
D |
73.90 |
| 75.01 |
39
|
S |
162.00 |
| 156.0 |
40
|
S |
121.11 |
| 120.9 |
41
|
D |
130.94 |
| 131.56 |
42
|
D |
115.18 |
| 115.72 |
43
|
S |
160.12 |
| 160.0 |
45
|
D |
115.18 |
| 115.72 |
46
|
D |
130.94 |
| 131.56 |
48
|
S |
155.94 |
| 157.1 |
49
|
D |
94.42 |
| 95.2 |
51
|
D |
70.25 |
| 70.61 |
52
|
Q |
18.16 |
| 18.25 |
53
|
D |
71.70 |
| 74.15 |
55
|
D |
69.40 |
| 72.49 |
57
|
D |
74.10 |
| 75.63 |
59
|
D |
75.90 |
| 76.41 |
61
|
D |
70.20 |
| 70.9 |
|
|
Atom |
Mult.(coupling const.) |
Prediction Shift |
| Prediction 0 acd_lotusv7 |
63
|
D |
123.82 |
| 122.64 |
64
|
D |
115.45 |
| 115.25 |
65
|
S |
149.24 |
| 149.15 |
|
|
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