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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 13.90 13.7
2 S 48.33 47.7
3 T 32.50 31.6
4 T 26.40 25.8
5 D 44.95 44.2
6 S 131.70 137.4
7 D 126.90 120.1
8 D 113.45 112.8
9 S 155.75 156.11
11 D 115.90 112.56
12 S 138.20 138.0
13 T 30.20 29.4
14 T 27.40 26.4
15 D 39.33 38.1
16 D 51.10 50.0
17 T 22.20 21.3
18 T 35.90 35.5
19 S 219.60 220.4




Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 13.70 13.9
2 S 47.70 48.33
3 T 31.60 32.5
4 T 25.80 26.4
5 D 44.20 44.95
6 S 137.40 131.7
7 D 120.10 126.9
8 D 112.80 113.45
9 S 156.11 155.75
11 D 112.56 115.9
12 S 138.00 138.2
13 T 29.40 30.2
14 T 26.40 27.4
15 D 38.10 39.33
16 D 50.00 51.1
17 T 21.30 22.2
18 T 35.50 35.9
19 S 220.40 219.6





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