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Spectral Data   Additional Data  
Type: 13C
Atom
No.
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
1 S 140.1 140.3140.3
2 D 130.4 130.6130.6
3 D 124.3 124.4124.4
4 S 151.4 151.4151.4
5 D 124.3 124.4124.4
6 D 130.4 130.6130.6
7 D 190.2 190.4190.4




Type: 13C
Atom
No.
Mult.(coupling const.)
Meas.
Shift
Intensity
expt-0
expt-1
ocmainz inhouse-2
1 S 140.3 0.121324 140.3140.1
2 D 130.6 1.0 130.6130.4
3 D 124.4 0.909314 124.4124.3
4 S 151.4 0.0612745 151.4151.4
5 D 124.4 0.909314 124.4124.3
6 D 130.6 1.0 130.6130.4
7 D 190.4 0.431373 190.4190.2




Type: 13C
Atom
No.
Mult.(coupling const.)
Meas.
Shift
expt-0
dkfz spektren database
expt-1
ocmainz inhouse-2
1 S 140.3 140.3140.1
2 D 130.6 130.6130.4
3 D 124.4 124.4124.3
4 S 151.4 151.4151.4
5 D 124.4 124.4124.3
6 D 130.6 130.6130.4
7 D 190.4 190.4190.2




Type: 1H
Atom
No.
Mult.(coupling const.)
Meas.
Shift
2-H 8.106 (H 12)
3-H 8.399 (H 13)
5-H
6-H
7-H 10.181 (H 16)





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