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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 S 136.3 136.05136.3
2 S 170.8 171.65170.8
6 T 126.2 126.55126.2
7 Q 17.5 17.317.5





Spectral Data   Additional Data   Download  
Type: 1H 60
Atom
Mult.(coupling const.)
Meas.
Shift
3-H
6-H 5.64, 6.23
7-H 1.98





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
Prediction 1
hose_lotusv7
1 S 136.05 136.3136.3
2 S 171.65 170.8170.8
6 T 126.55 126.2126.2
7 Q 17.30 17.517.5





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
Prediction 1
acd_lotusv7
1 S 136.3 136.3136.05
2 S 170.8 170.8171.65
6 T 126.2 126.2126.55
7 Q 17.5 17.517.3






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