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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 D 126.1 126.07126.64
2 D 128.8 128.68128.8
3 D 128.4 128.58128.4
4 S 139.8 140.15139.8
5 D 128.4 128.58128.4
6 D 128.8 128.68128.8
7 T 40.2 39.9740.2
8 T 43.6 43.4743.6





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1 D 126.07 126.1126.64
2 D 128.68 128.8128.8
3 D 128.58 128.4128.4
4 S 140.15 139.8139.8
5 D 128.58 128.4128.4
6 D 128.68 128.8128.8
7 T 39.97 40.240.2
8 T 43.47 43.643.6





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1 D 126.64 126.1126.07
2 D 128.80 128.8128.68
3 D 128.40 128.4128.58
4 S 139.80 139.8140.15
5 D 128.40 128.4128.58
6 D 128.80 128.8128.68
7 T 40.20 40.239.97
8 T 43.60 43.643.47






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