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Spectral Data   Additional Data   Download  
Type: 13C 300
Atom
Mult.(coupling const.)
Meas.
Shift
Intensity
Prediction 0
acd_lotusv7
Prediction 1
hose_lotusv7
1 T 28.606 27.899 29.1228.61
2 T 28.606 27.899 29.1428.61
4 T 24.467 16.316 24.5625.63
6 T 33.815 14.263 33.9233.8
8 S 177.080 5.37 179.44174.7





Spectral Data   Additional Data   Download  
1H Spectrum
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Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
Prediction 1
hose_lotusv7
1 T 29.12 28.60628.61
2 T 29.14 28.60628.61
3 T 29.14 28.61
4 T 24.56 24.46725.63
5 T 24.56 25.63
6 T 33.92 33.81533.8
7 T 33.92 33.8
8 S 179.44 177.08174.7
9 S 179.44 174.7





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
Prediction 1
acd_lotusv7
1 T 28.61 28.60629.12
2 T 28.61 28.60629.14
3 T 28.61 29.14
4 T 25.63 24.46724.56
5 T 25.63 24.56
6 T 33.80 33.81533.92
7 T 33.80 33.92
8 S 174.70 177.08179.44
9 S 174.70 179.44






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