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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
S
187.6
187.6
187.6
2
D
133.9
133.9
133.9
3
S
146.7
146.7
146.7
4
S
182.0
182.0
182.0
5
S
158.9
158.9
158.9
6
D
107.3
107.3
107.3
7
T
35.0
35.0
35.0
8
S
136.0
136.4
136.0
9
D
129.5
129.5
129.5
10
D
128.9
128.9
128.9
11
D
127.1
127.1
126.96
12
D
128.9
128.9
128.9
13
D
129.5
129.5
129.5
14
Q
56.5
56.5
56.27
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1
S
187.6
187.6
187.6
2
D
133.9
133.9
133.9
3
S
146.7
146.7
146.7
4
S
182.0
182.0
182.0
5
S
158.9
158.9
158.9
6
D
107.3
107.3
107.3
7
T
35.0
35.0
35.0
8
S
136.4
136.0
136.0
9
D
129.5
129.5
129.5
10
D
128.9
128.9
128.9
11
D
127.1
127.1
126.96
12
D
128.9
128.9
128.9
13
D
129.5
129.5
129.5
14
Q
56.5
56.5
56.27
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1
S
187.60
187.6
187.6
2
D
133.90
133.9
133.9
3
S
146.70
146.7
146.7
4
S
182.00
182.0
182.0
5
S
158.90
158.9
158.9
6
D
107.30
107.3
107.3
7
T
35.00
35.0
35.0
8
S
136.00
136.0
136.4
9
D
129.50
129.5
129.5
10
D
128.90
128.9
128.9
11
D
126.96
127.1
127.1
12
D
128.90
128.9
128.9
13
D
129.50
129.5
129.5
14
Q
56.27
56.5
56.5
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