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General   sdbs  
Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
ocmainz inhouse-2
expt-2
sdbs
Prediction 3
acd_lotusv7
Prediction 4
hose_lotusv7
1 S 136.4 136.2136.3136.42136.3136.31
2 S 136.4 136.2136.3136.3136.31
3 D 129.9 129.7129.5129.6129.7
4 D 126.1 125.9125.8125.67125.94
5 D 126.1 125.9125.8125.85125.67125.94
6 D 129.9 129.7129.5129.63129.6129.7
7 Q 19.6 19.619.619.6619.419.6
8 Q 19.6 19.619.619.419.6





Spectral Data   Additional Data   Download  
Type: 1H 60
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
sdbs
3-H 6.95
4-H 6.95
5-H 6.95 7.07
6-H 6.95 7.07
7-H 2.20 2.22
8-H 2.20





Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
expt-2
sdbs
Prediction 3
acd_lotusv7
Prediction 4
hose_lotusv7
1 S 136.3 136.2136.4136.42136.3136.31
2 S 136.3 136.2136.4136.3136.31
3 D 129.5 129.7129.9129.6129.7
4 D 125.8 125.9126.1125.67125.94
5 D 125.8 125.9126.1125.85125.67125.94
6 D 129.5 129.7129.9129.63129.6129.7
7 Q 19.6 19.619.619.6619.419.6
8 Q 19.6 19.619.619.419.6





Spectral Data   Additional Data   Download  
Type: 13C 23
Atom
Mult.(coupling const.)
Meas.
Shift
Intensity
expt-0
expt-1
ocmainz inhouse-2
expt-2
sdbs
Prediction 3
acd_lotusv7
Prediction 4
hose_lotusv7
1 S 136.2 0.252 136.4136.3136.42136.3136.31
2 S 136.2 0.252 136.4136.3136.3136.31
3 D 129.7 0.693 129.9129.5129.6129.7
4 D 125.9 1.0 126.1125.8125.67125.94
5 D 125.9 1.0 126.1125.8125.85125.67125.94
6 D 129.7 0.693 129.9129.5129.63129.6129.7
7 Q 19.6 0.673 19.619.619.6619.419.6
8 Q 19.6 0.673 19.619.619.419.6





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
expt-2
ocmainz inhouse-2
expt-3
sdbs
Prediction 4
hose_lotusv7
1 S 136.30 136.2136.4136.3136.42136.31
2 S 136.30 136.2136.4136.3136.31
3 D 129.60 129.7129.9129.5129.7
4 D 125.67 125.9126.1125.8125.94
5 D 125.67 125.9126.1125.8125.85125.94
6 D 129.60 129.7129.9129.5129.63129.7
7 Q 19.40 19.619.619.619.6619.6
8 Q 19.40 19.619.619.619.6





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
expt-2
ocmainz inhouse-2
expt-3
sdbs
Prediction 4
acd_lotusv7
1 S 136.31 136.2136.4136.3136.42136.3
2 S 136.31 136.2136.4136.3136.3
3 D 129.70 129.7129.9129.5129.6
4 D 125.94 125.9126.1125.8125.67
5 D 125.94 125.9126.1125.8125.85125.67
6 D 129.70 129.7129.9129.5129.63129.6
7 Q 19.60 19.619.619.619.6619.4
8 Q 19.60 19.619.619.619.4






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