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Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1 Q 12.00 12.3
2 T 23.10 23.0
3 D 45.83 46.05
4 T 26.10 26.4
5 T 33.97 34.0
6 D 35.32 36.3
7 Q 18.83 18.8
8 D 51.40 57.23
9 T 28.74 29.4
10 T 27.52 24.9
11 D 50.94 51.8
12 D 38.66 38.52
13 D 81.43 73.99
16 D 119.92 126.95
17 S 148.84 146.0
18 T 42.20 41.8
19 D 71.41 71.2
21 T 31.36 31.6
22 T 36.31 37.5
23 S 38.46 36.5
24 Q 21.70 16.19
25 D 42.50 46.1
26 T 21.84 21.67
27 T 37.25 39.7
28 S 42.37 42.6
29 Q 20.73 12.0
30 D 29.17 28.95
31 Q 18.85 19.2
32 Q 20.00 19.2





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 12.30 12.0
2 T 23.00 23.1
3 D 46.05 45.83
4 T 26.40 26.1
5 T 34.00 33.97
6 D 36.30 35.32
7 Q 18.80 18.83
8 D 57.23 51.4
9 T 29.40 28.74
10 T 24.90 27.52
11 D 51.80 50.94
12 D 38.52 38.66
13 D 73.99 81.43
16 D 126.95 119.92
17 S 146.00 148.84
18 T 41.80 42.2
19 D 71.20 71.41
21 T 31.60 31.36
22 T 37.50 36.31
23 S 36.50 38.46
24 Q 16.19 21.7
25 D 46.10 42.5
26 T 21.67 21.84
27 T 39.70 37.25
28 S 42.60 42.37
29 Q 12.00 20.73
30 D 28.95 29.17
31 Q 19.20 18.85
32 Q 19.20 20.0






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