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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 S 104.4 105.53104.4
2 D 131.9 134.6131.9
3 D 108.0 108.73108.0
4 S 164.0 165.07164.0
5 D 102.3 103.55102.3
6 S 163.4 164.72163.4
7 S 172.0 172.11172.0




Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1 S 105.53 104.4104.4
2 D 134.60 131.9131.9
3 D 108.73 108.0108.0
4 S 165.07 164.0164.0
5 D 103.55 102.3102.3
6 S 164.72 163.4163.4
7 S 172.11 172.0172.0




Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1 S 104.4 104.4105.53
2 D 131.9 131.9134.6
3 D 108.0 108.0108.73
4 S 164.0 164.0165.07
5 D 102.3 102.3103.55
6 S 163.4 163.4164.72
7 S 172.0 172.0172.11





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