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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 T 112.35 109.89
2 S 145.15 144.78
3 T 32.00 32.3
4 T 35.25 28.97
5 D 69.20 71.49
7 T 46.00 32.06
8 S 135.20 140.93
9 D 122.45 133.03
10 D 117.60 121.75
11 S 141.44 151.8
12 T 28.85 35.05
13 T 22.18 22.79
14 T 39.14 39.7
15 S 45.56 44.23
16 Q 16.70 11.94
17 D 56.37 49.53
18 T 23.41 24.7
19 T 27.80 28.27
20 D 56.60 56.14
21 D 40.30 40.62
22 Q 20.97 20.26
23 D 135.60 133.93
24 D 132.00 134.37
25 D 42.85 43.06
26 Q 17.63 17.66
27 D 33.10 33.36
28 Q 19.00 20.0
29 Q 21.00 20.0





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 T 109.89 112.35
2 S 144.78 145.15
3 T 32.30 32.0
4 T 28.97 35.25
5 D 71.49 69.2
7 T 32.06 46.0
8 S 140.93 135.2
9 D 133.03 122.45
10 D 121.75 117.6
11 S 151.80 141.44
12 T 35.05 28.85
13 T 22.79 22.18
14 T 39.70 39.14
15 S 44.23 45.56
16 Q 11.94 16.7
17 D 49.53 56.37
18 T 24.70 23.41
19 T 28.27 27.8
20 D 56.14 56.6
21 D 40.62 40.3
22 Q 20.26 20.97
23 D 133.93 135.6
24 D 134.37 132.0
25 D 43.06 42.85
26 Q 17.66 17.63
27 D 33.36 33.1
28 Q 20.00 19.0
29 Q 20.00 21.0






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