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Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1 Q 21.46 20.68
2 S 170.81 170.61
5 D 64.89 76.65
6 T 25.35 33.2
7 D 52.79 49.63
8 S 39.83 40.4
9 Q 19.75 19.2
10 S 127.70 134.6
11 D 136.94 137.4
13 D 140.09 140.95
14 S 120.81 123.4
15 D 77.32 80.0
17 T 27.62 26.47
18 D 60.11 58.0
19 S 38.70 37.43
20 Q 16.10 16.0
21 T 40.06 39.7
22 T 18.36 18.53
23 T 42.00 42.15
24 S 33.23 33.25
25 Q 31.37 27.25
26 Q 27.75 27.25
27 D 56.44 56.63
28 T 18.83 18.13
29 T 42.77 41.63
30 S 36.84 37.17
31 Q 17.38 17.14





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 20.68 21.46
2 S 170.61 170.81
5 D 76.65 64.89
6 T 33.20 25.35
7 D 49.63 52.79
8 S 40.40 39.83
9 Q 19.20 19.75
10 S 134.60 127.7
11 D 137.40 136.94
13 D 140.95 140.09
14 S 123.40 120.81
15 D 80.00 77.32
17 T 26.47 27.62
18 D 58.00 60.11
19 S 37.43 38.7
20 Q 16.00 16.1
21 T 39.70 40.06
22 T 18.53 18.36
23 T 42.15 42.0
24 S 33.25 33.23
25 Q 27.25 31.37
26 Q 27.25 27.75
27 D 56.63 56.44
28 T 18.13 18.83
29 T 41.63 42.77
30 S 37.17 36.84
31 Q 17.14 17.38






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