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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 55.34 55.95
3 S 147.29 148.97
4 D 110.54 110.48
5 S 126.28 132.4
6 S 126.28 125.9
7 D 109.12 109.0
8 S 146.99 146.8
10 Q 55.34 55.47
11 T 58.23 57.58
13 T 51.00 51.35
14 T 27.80 28.7
15 S 125.70 126.57
16 D 111.10 109.33
17 S 147.70 147.21
19 Q 55.70 55.95
20 S 147.20 147.3
22 Q 55.20 55.78
23 D 108.80 110.27
24 S 128.36 129.6
25 D 59.30 59.2
26 T 36.35 36.7





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 55.95 55.34
3 S 148.97 147.29
4 D 110.48 110.54
5 S 132.40 126.28
6 S 125.90 126.28
7 D 109.00 109.12
8 S 146.80 146.99
10 Q 55.47 55.34
11 T 57.58 58.23
13 T 51.35 51.0
14 T 28.70 27.8
15 S 126.57 125.7
16 D 109.33 111.1
17 S 147.21 147.7
19 Q 55.95 55.7
20 S 147.30 147.2
22 Q 55.78 55.2
23 D 110.27 108.8
24 S 129.60 128.36
25 D 59.20 59.3
26 T 36.70 36.35






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