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This molecule with some stereoconfiguration:


Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 S 175.7 177.2176.9175.45176.55
2 Q 20.3 20.720.820.720.59





Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 S 176.9 177.2175.7175.45176.55
2 Q 20.8 20.720.320.720.59





Spectral Data   Additional Data   Download  
Type: 1H 300.1
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 2.08 2.122.11.961.911.551.961.99
3-H





Spectral Data   Additional Data   Download  
Type: 1H 300.1
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 1.99 2.122.11.961.911.551.962.08
3-H





Spectral Data   Additional Data   Download  
Type: 1H 300.1
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 1.96 2.122.11.961.911.551.992.08
3-H





Spectral Data   Additional Data   Download  
Type: 1H 300.1
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 1.55 2.122.11.961.911.961.992.08
3-H





Spectral Data   Additional Data   Download  
Type: 1H 300.1
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 1.91 2.122.11.961.551.961.992.08
3-H





Spectral Data   Additional Data   Download  
Type: 1H 300.1
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 1.96 2.122.11.911.551.961.992.08
3-H





Spectral Data   Additional Data   Download  
Type: 1H 300.1
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 2.1 2.121.961.911.551.961.992.08
3-H





Spectral Data   Additional Data   Download  
Type: 1H 60
Atom
Mult.(coupling const.)
Meas.
Shift
expt-0
expt-1
expt-2
expt-3
expt-4
expt-5
expt-6
2-H 2.12 2.11.961.911.551.961.992.08
3-H





Spectral Data   Additional Data   Download  
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
Intensity
expt-0
expt-1
Prediction 2
acd_lotusv7
Prediction 3
hose_lotusv7
1 S 177.2 0.89 176.9175.7175.45176.55
2 Q 20.7 1.0 20.820.320.720.59





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
expt-2
Prediction 3
hose_lotusv7
1 S 175.45 177.2176.9175.7176.55
2 Q 20.70 20.720.820.320.59





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
dkfz spektren database
expt-1
expt-2
Prediction 3
acd_lotusv7
1 S 176.55 177.2176.9175.7175.45
2 Q 20.59 20.720.820.320.7






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