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Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
ocmainz inhouse database
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 S 129.2 129.4129.8129.61129.47
2 D 131.4 131.6131.2131.23131.38
3 D 115.7 115.9115.5115.59115.68
4 S 161.9 162.6161.0162.64161.76
5 D 115.7 115.9115.5115.59115.68
6 D 131.4 131.6131.2131.23131.38
7 S 199.3 199.7198.2197.5199.01
8 Q 26.3 26.226.325.9726.07





Spectral Data   Additional Data   Download  
Type: 13C 75
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 129.8 129.4129.2129.61129.47
2 D 131.2 131.6131.4131.23131.38
3 D 115.5 115.9115.7115.59115.68
4 S 161.0 162.6161.9162.64161.76
5 D 115.5 115.9115.7115.59115.68
6 D 131.2 131.6131.4131.23131.38
7 S 198.2 199.7199.3197.5199.01
8 Q 26.3 26.226.325.9726.07





Spectral Data   Additional Data   Download  
Type: 13C 23
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
ocmainz inhouse database
expt-1
ocmainz inhouse-2
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 S 129.4 129.8129.2129.61129.47
2 D 131.6 131.2131.4131.23131.38
3 D 115.9 115.5115.7115.59115.68
4 S 162.6 161.0161.9162.64161.76
5 D 115.9 115.5115.7115.59115.68
6 D 131.6 131.2131.4131.23131.38
7 S 199.7 198.2199.3197.5199.01
8 Q 26.2 26.326.325.9726.07





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
ocmainz inhouse database
expt-2
ocmainz inhouse-2
Prediction 3
hose_lotusv7
1 S 129.61 129.4129.8129.2129.47
2 D 131.23 131.6131.2131.4131.38
3 D 115.59 115.9115.5115.7115.68
4 S 162.64 162.6161.0161.9161.76
5 D 115.59 115.9115.5115.7115.68
6 D 131.23 131.6131.2131.4131.38
7 S 197.50 199.7198.2199.3199.01
8 Q 25.97 26.226.326.326.07





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
ocmainz inhouse database
expt-2
ocmainz inhouse-2
Prediction 3
acd_lotusv7
1 S 129.47 129.4129.8129.2129.61
2 D 131.38 131.6131.2131.4131.23
3 D 115.68 115.9115.5115.7115.59
4 S 161.76 162.6161.0161.9162.64
5 D 115.68 115.9115.5115.7115.59
6 D 131.38 131.6131.2131.4131.23
7 S 199.01 199.7198.2199.3197.5
8 Q 26.07 26.226.326.325.97






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