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This molecule with other stereoconfigurations:


Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1 Q 13.86 13.44
2 T 25.81 25.86
3 D 135.91 136.54
4 D 129.51 129.63
5 D 131.97 134.09
6 D 132.02 134.09
7 D 130.81 129.9
8 D 134.41 138.84
9 T 32.78 32.61
10 T 29.70 29.4
11 T 29.26 29.4
12 T 28.89 29.23
13 T 29.64 29.52
14 T 29.51 30.86
15 T 23.10 23.55
16 T 36.80 39.14
17 S 80.00 76.73
18 Q 24.85 23.27
19 T 40.30 50.9
20 S 82.40 80.53
21 Q 23.33 23.64
23 S 173.95 175.3
25 T 34.15 37.27
26 D 80.75 77.86





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 13.44 13.86
2 T 25.86 25.81
3 D 136.54 135.91
4 D 129.63 129.51
5 D 134.09 131.97
6 D 134.09 132.02
7 D 129.90 130.81
8 D 138.84 134.41
9 T 32.61 32.78
10 T 29.40 29.7
11 T 29.40 29.26
12 T 29.23 28.89
13 T 29.52 29.64
14 T 30.86 29.51
15 T 23.55 23.1
16 T 39.14 36.8
17 S 76.73 80.0
18 Q 23.27 24.85
19 T 50.90 40.3
20 S 80.53 82.4
21 Q 23.64 23.33
23 S 175.30 173.95
25 T 37.27 34.15
26 D 77.86 80.75






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