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Spectral Data   Additional Data   Download  
Type: 13C Unreported Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
Prediction 1
acd_lotusv7
Prediction 2
hose_lotusv7
1 Q 27.5 29.329.1228.27
2 S 206.3 208.4209.01207.2
3 T 35.2 36.836.6335.89
4 Q 7.0 8.07.797.43

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Spectral Data   Additional Data   Download  
Type: 1H 60 Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
1-H 2.10
3-H 2.40
4-H 1.05

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Spectral Data   Additional Data   Download  
Type: 13C Unreported Double click to get resizeable window!
Atom
Mult.(coupling const.)
Meas.
Shift
Intensity
expt-0
Prediction 1
acd_lotusv7
Prediction 2
hose_lotusv7
1 Q 29.3 0.80308 27.529.1228.27
2 S 208.4 0.448845 206.3209.01207.2
3 T 36.8 1.0 35.236.6335.89
4 Q 8.0 0.976898 7.07.797.43

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Spectral Data   Additional Data   Download  
Type: 13C Double click to get resizeable window!
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
Prediction 2
hose_lotusv7
1 Q 29.12 29.327.528.27
2 S 209.01 208.4206.3207.2
3 T 36.63 36.835.235.89
4 Q 7.79 8.07.07.43

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Spectral Data   Additional Data   Download  
Type: 13C Double click to get resizeable window!
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
Prediction 2
acd_lotusv7
1 Q 28.27 29.327.529.12
2 S 207.20 208.4206.3209.01
3 T 35.89 36.835.236.63
4 Q 7.43 8.07.07.79

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