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Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1 Q 18.50 18.3
2 D 36.80 37.6
3 Q 17.40 18.3
4 S 86.60 85.9
6 T 31.40 32.35
7 T 41.09 39.49
8 S 43.90 42.5
9 Q 20.20 22.98
10 T 43.44 40.74
11 D 122.92 121.2
12 S 136.40 141.86
13 T 68.60 67.44
15 T 37.00 40.3
16 D 71.40 70.2
18 S 166.80 166.76
20 S 121.90 123.3
21 D 131.80 133.0
22 D 115.30 115.67
23 S 160.70 161.78
25 D 115.30 115.67
26 D 131.80 133.0
27 D 60.00 53.1





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 18.30 18.5
2 D 37.60 36.8
3 Q 18.30 17.4
4 S 85.90 86.6
6 T 32.35 31.4
7 T 39.49 41.09
8 S 42.50 43.9
9 Q 22.98 20.2
10 T 40.74 43.44
11 D 121.20 122.92
12 S 141.86 136.4
13 T 67.44 68.6
15 T 40.30 37.0
16 D 70.20 71.4
18 S 166.76 166.8
20 S 123.30 121.9
21 D 133.00 131.8
22 D 115.67 115.3
23 S 161.78 160.7
25 D 115.67 115.3
26 D 133.00 131.8
27 D 53.10 60.0






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