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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 20.19 20.0
2 D 33.30 33.36
3 Q 19.67 20.0
4 D 43.15 43.06
5 Q 18.20 17.66
6 D 132.19 134.37
7 D 136.31 133.93
8 D 40.62 40.62
9 Q 20.62 20.26
10 D 51.05 49.11
11 T 27.18 26.9
12 T 33.68 33.9
13 S 47.73 47.0
14 Q 17.28 18.3
15 D 41.39 40.26
16 T 24.02 20.18
17 T 36.17 35.15
18 T 24.02 24.6
19 T 44.64 42.49
20 D 68.40 69.1
22 T 30.18 31.46
23 T 27.99 35.15
24 S 25.48 24.6
25 T 25.07 25.4
26 S 140.54 149.44
27 D 117.84 118.7
28 T 38.09 37.2
29 S 43.79 44.3
30 Q 15.18 14.3





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 20.00 20.19
2 D 33.36 33.3
3 Q 20.00 19.67
4 D 43.06 43.15
5 Q 17.66 18.2
6 D 134.37 132.19
7 D 133.93 136.31
8 D 40.62 40.62
9 Q 20.26 20.62
10 D 49.11 51.05
11 T 26.90 27.18
12 T 33.90 33.68
13 S 47.00 47.73
14 Q 18.30 17.28
15 D 40.26 41.39
16 T 20.18 24.02
17 T 35.15 36.17
18 S 24.60 24.02
19 T 42.49 44.64
20 D 69.10 68.4
22 T 31.46 30.18
23 T 35.15 27.99
24 S 24.60 25.48
25 T 25.40 25.07
26 S 149.44 140.54
27 D 118.70 117.84
28 T 37.20 38.09
29 S 44.30 43.79
30 Q 14.30 15.18






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