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This molecule with some stereoconfiguration:


General   sdbs  
Spectral Data   Additional Data   Download  
Type: 13C Unreported Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
sdbs
Prediction 1
acd_lotusv7
Prediction 2
hose_lotusv7
9 T 29.6 29.5528.5829.6
10 T 42.7 42.7141.7942.7
4 D 111.3 111.29111.36111.2
8 S 112.6 112.6112.6112.6
1 D 118.1 118.06118.18118.1
2 D 118.3 118.3119.43119.22
3 D 120.8 120.75119.55120.24
7 D 122.5 122.53122.57122.5
6 S 127.4 127.4127.38127.4
5 S 136.3 136.34136.53136.3

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Spectral Data   Additional Data   Download  
Type: 13C Double click to get resizeable window!
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
expt-1
sdbs
Prediction 2
hose_lotusv7
9 T 28.58 29.629.5529.6
10 T 41.79 42.742.7142.7
4 D 111.36 111.3111.29111.2
8 S 112.60 112.6112.6112.6
1 D 118.18 118.1118.06118.1
2 D 119.43 118.3118.3119.22
3 D 119.55 120.8120.75120.24
7 D 122.57 122.5122.53122.5
6 S 127.38 127.4127.4127.4
5 S 136.53 136.3136.34136.3

Double click upper part to get resizeable window!



Spectral Data   Additional Data   Download  
Type: 13C Double click to get resizeable window!
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
expt-1
sdbs
Prediction 2
acd_lotusv7
9 T 29.60 29.629.5528.58
10 T 42.70 42.742.7141.79
4 D 111.20 111.3111.29111.36
8 S 112.60 112.6112.6112.6
1 D 118.10 118.1118.06118.18
2 D 119.22 118.3118.3119.43
3 D 120.24 120.8120.75119.55
7 D 122.50 122.5122.53122.57
6 S 127.40 127.4127.4127.38
5 S 136.30 136.3136.34136.53

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