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This molecule with some stereoconfiguration:


General   ocmainz inhouse-2  
Spectral Data   Additional Data   Download  
Type: 13C Unreported Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
ocmainz inhouse-2
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 S 112.8 114.4114.2112.25114.4
2 S 161.5 162.9162.9162.2162.9
3 D 116.9 118.4118.4117.8118.4
4 D 135.2 136.7136.7135.93136.7
5 D 118.7 120.3120.3119.8120.3
6 D 130.2 131.7131.7130.8131.7
7 S 172.2 173.6172.4173.6

Double click upper part to get resizeable window!



Spectral Data   Additional Data   Download  
Type: 13C Unreported Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
ocmainz inhouse-2
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 S 114.2 114.4112.8112.25114.4
2 S 162.9 162.9161.5162.2162.9
3 D 118.4 118.4116.9117.8118.4
4 D 136.7 136.7135.2135.93136.7
5 D 120.3 120.3118.7119.8120.3
6 D 131.7 131.7130.2130.8131.7

Double click upper part to get resizeable window!




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