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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 112.10 110.9
2 S 148.20 147.49
3 Q 20.30 20.41
4 D 52.63 47.3
5 D 139.41 135.44
6 D 117.09 135.02
7 S 126.09 128.85
8 S 152.57 138.07
9 Q 13.44 18.57
10 D 100.16 96.81
13 S 170.47 170.15
15 T 27.80 30.56
16 T 42.20 42.0
17 S 211.72 208.0
18 Q 30.10 31.0





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 T 110.90 112.1
2 S 147.49 148.2
3 Q 20.41 20.3
4 D 47.30 52.63
5 D 135.44 139.41
6 D 135.02 117.09
7 S 128.85 126.09
8 S 138.07 152.57
9 Q 18.57 13.44
10 D 96.81 100.16
13 S 170.15 170.47
15 T 30.56 27.8
16 T 42.00 42.2
17 S 208.00 211.72
18 Q 31.00 30.1






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