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Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
Prediction 0
acd_lotusv7
Prediction 1
hose_lotusv7
1 D 126.5 126.5126.5
2 D 113.9 113.9113.9
3 S 155.8 155.8154.25
4 S 120.6 120.6120.6
5 S 139.2 139.2139.2
6 S 127.3 127.3127.3
7 T 26.2 26.226.2
8 T 26.6 26.626.6
9 S 138.5 138.5138.5
10 S 135.2 135.2135.2
11 D 123.1 123.1123.1
12 D 122.9 122.9122.9
13 S 138.7 138.7138.7
14 S 136.5 136.5136.5
15 Q 11.5 11.511.6
16 S 135.2 135.2135.2
17 S 120.6 120.6120.6
18 T 63.1 63.163.1





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1 D 126.5 126.5126.5
2 D 113.9 113.9113.9
3 S 155.8 155.8154.25
4 T 120.6 120.6120.6
5 S 139.2 139.2139.2
6 S 127.3 127.3127.3
7 T 26.2 26.226.2
8 T 26.6 26.626.6
9 S 138.5 138.5138.5
10 D 135.2 135.2135.2
11 D 123.1 123.1123.1
12 D 122.9 122.9122.9
13 S 138.7 138.7138.7
14 S 136.5 136.5136.5
15 Q 11.5 11.511.6
16 D 135.2 135.2135.2
17 T 120.6 120.6120.6
18 T 63.1 63.163.1





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1 D 126.50 126.5126.5
2 D 113.90 113.9113.9
3 S 154.25 155.8155.8
4 T 120.60 120.6120.6
5 S 139.20 139.2139.2
6 S 127.30 127.3127.3
7 T 26.20 26.226.2
8 T 26.60 26.626.6
9 S 138.50 138.5138.5
10 D 135.20 135.2135.2
11 D 123.10 123.1123.1
12 D 122.90 122.9122.9
13 S 138.70 138.7138.7
14 S 136.50 136.5136.5
15 Q 11.60 11.511.5
16 D 135.20 135.2135.2
17 T 120.60 120.6120.6
18 T 63.10 63.163.1






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