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Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1 Q 56.11 56.19
3 S 161.39 161.26
4 D 100.97 99.48
5 S 161.16 164.12
7 D 100.07 102.4
9 D 77.30 78.4
10 T 60.70 60.81
12 D 69.80 71.27
14 D 76.60 78.34
16 D 73.10 76.3
18 D 97.57 96.5
19 S 158.18 156.36
21 S 145.33 146.6
22 S 122.15 120.3
23 D 107.43 109.0
24 S 145.60 146.9
26 S 136.00 138.0
28 S 145.60 146.9
30 D 107.43 109.0
31 S 136.99 136.6
33 S 173.30 171.7
35 S 106.04 106.0





Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 56.19 56.11
3 S 161.26 161.39
4 D 99.48 100.97
5 S 164.12 161.16
7 D 102.40 100.07
9 D 78.40 77.3
10 T 60.81 60.7
12 D 71.27 69.8
14 D 78.34 76.6
16 D 76.30 73.1
18 D 96.50 97.57
19 S 156.36 158.18
21 S 146.60 145.33
22 S 120.30 122.15
23 D 109.00 107.43
24 S 146.90 145.6
26 S 138.00 136.0
28 S 146.90 145.6
30 D 109.00 107.43
31 S 136.60 136.99
33 S 171.70 173.3
35 S 106.00 106.04






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