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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 21.80 13.6
2 S 136.10 135.23
3 D 127.74 127.26
4 T 22.52 23.24
5 T 39.66 41.18
6 S 74.98 75.67
7 Q 26.61 26.21
9 D 55.04 46.97
10 T 25.59 23.97
11 T 41.30 40.79
12 S 81.90 74.73
13 Q 24.60 24.97
15 D 45.45 43.3
16 Q 14.21 18.6
17 T 60.90 66.6




Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 13.60 21.8
2 S 135.23 136.1
3 D 127.26 127.74
4 T 23.24 22.52
5 T 41.18 39.66
6 S 75.67 74.98
7 Q 26.21 26.61
9 D 46.97 55.04
10 T 23.97 25.59
11 T 40.79 41.3
12 S 74.73 81.9
13 Q 24.97 24.6
15 D 43.30 45.45
16 Q 18.60 14.21
17 T 66.60 60.9





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