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Details
Spectral Data
Additional Data
Download
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
Prediction 0
acd_lotusv7
Prediction 1
hose_lotusv7
1
D
120.0
122.87
120.0
2
D
116.5
117.33
116.5
3
S
143.9
144.1
143.9
4
S
144.9
145.0
144.9
5
D
115.3
118.22
115.3
6
S
125.6
127.69
125.6
7
T
40.4
41.84
40.4
8
S
173.2
179.39
173.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1
D
122.87
120.0
120.0
2
D
117.33
116.5
116.5
3
S
144.10
143.9
143.9
4
S
145.00
144.9
144.9
5
D
118.22
115.3
115.3
6
S
127.69
125.6
125.6
7
T
41.84
40.4
40.4
8
S
179.39
173.2
173.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1
D
120.0
120.0
122.87
2
D
116.5
116.5
117.33
3
S
143.9
143.9
144.1
4
S
144.9
144.9
145.0
5
D
115.3
115.3
118.22
6
S
125.6
125.6
127.69
7
T
40.4
40.4
41.84
8
S
173.2
173.2
179.39
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