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This molecule without stereoconfiguration:

This molecule with other stereoconfigurations:


Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1 Q 19.80 19.4
2 S 46.70 46.67
3 Q 19.21 19.4
4 D 43.55 43.11
5 T 28.00 27.16
6 T 30.69 30.04
7 S 57.49 57.41
8 Q 9.36 9.39
9 S 218.40 217.67
11 T 43.39 43.17





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 19.40 19.8
2 S 46.67 46.7
3 Q 19.40 19.21
4 D 43.11 43.55
5 T 27.16 28.0
6 T 30.04 30.69
7 S 57.41 57.49
8 Q 9.39 9.36
9 S 217.67 218.4
11 T 43.17 43.39






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