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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
129.9
129.8
129.9
2
S
137.4
142.1
137.4
3
S
146.9
142.15
146.9
4
S
32.7
32.65
32.7
5
T
41.0
40.95
41.0
6
D
134.5
134.4
134.5
7
D
191.8
191.75
191.8
8
Q
17.1
17.35
17.1
9
Q
26.2
26.2
26.2
10
Q
26.2
26.2
26.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1
D
129.80
129.9
129.9
2
S
142.10
137.4
137.4
3
S
142.15
146.9
146.9
4
S
32.65
32.7
32.7
5
T
40.95
41.0
41.0
6
D
134.40
134.5
134.5
7
D
191.75
191.8
191.8
8
Q
17.35
17.1
17.1
9
Q
26.20
26.2
26.2
10
Q
26.20
26.2
26.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1
D
129.9
129.9
129.8
2
S
137.4
137.4
142.1
3
S
146.9
146.9
142.15
4
S
32.7
32.7
32.65
5
T
41.0
41.0
40.95
6
D
134.5
134.5
134.4
7
D
191.8
191.8
191.75
8
Q
17.1
17.1
17.35
9
Q
26.2
26.2
26.2
10
Q
26.2
26.2
26.2
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