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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 132.3 132.43132.3
2 D 107.5 107.3107.5
3 S 166.0 165.85166.0
4 D 100.8 100.69100.8
5 S 165.2 164.76165.2
6 S 113.8 113.73113.8
7 Q 26.2 26.1726.05
8 S 202.5 202.59202.5
9 Q 55.5 55.4755.55





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1 D 132.43 132.3132.3
2 D 107.30 107.5107.5
3 S 165.85 166.0166.0
4 D 100.69 100.8100.8
5 S 164.76 165.2165.2
6 S 113.73 113.8113.8
7 Q 26.17 26.226.05
8 S 202.59 202.5202.5
9 Q 55.47 55.555.55





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1 D 132.30 132.3132.43
2 D 107.50 107.5107.3
3 S 166.00 166.0165.85
4 D 100.80 100.8100.69
5 S 165.20 165.2164.76
6 S 113.80 113.8113.73
7 Q 26.05 26.226.17
8 S 202.50 202.5202.59
9 Q 55.55 55.555.47






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