Home
Current usage is:
Registered Users: 3118
Structures: 271816
Spectra: Measured 70029, calculated 396583
Username:
Password:
Use cookies for persistant login
Create New Account
(Only necessary for
contributing data)
  Forgot password?  
ImpressumProblems using nmrshiftdb2? See our tips on browsers to use !
  Home     Search     Results     Quick Check     Predict     Assignment     Submit     Review     Help  
  Search Results  
  You did not do a search!  
     
  Bookmarks  
  You could bookmark structures if you were logged in!  
     
  Details  
 


This molecule with other stereoconfigurations:


Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1 Q 58.80 57.75
3 D 78.43 78.27
4 T 37.20 36.2
5 D 100.30 102.4
7 D 83.30 83.6
8 D 78.00 78.27
10 Q 58.40 57.75
11 T 36.60 37.2
12 D 97.30 98.26
14 D 79.30 77.8
15 T 29.80 30.18
16 T 39.25 37.79
17 S 38.77 39.81
18 Q 18.53 22.05
19 S 139.35 140.59
20 D 119.05 126.67
21 T 37.03 32.31
22 S 74.30 76.45
24 D 44.30 47.9
25 T 24.70 34.7
26 D 72.27 80.81
28 S 166.27 165.7
30 D 113.60 114.9
31 S 165.85 145.03
32 Q 16.52 15.71
33 D 38.15 37.3
34 Q 21.00 21.6
35 Q 20.90 21.6
36 S 58.00 48.43
37 Q 10.30 21.79
38 S 91.95 87.34
40 S 209.10 211.6
41 Q 27.33 24.5
43 T 32.57 34.58
44 T 34.05 33.36
45 S 88.75 85.6
47 T 38.95 39.26
49 D 69.80 69.73
50 Q 18.50 18.23
52 D 68.90 69.73
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
53 Q 18.50 18.23
54 D 83.10 83.65
56 D 102.00 98.26
57 T 37.00 36.4
58 D 81.30 72.65
60 Q 57.00 56.7
61 D 76.10 71.64
63 D 72.90 73.57
64 Q 18.60 19.2




Spectral Data   Additional Data   Download  
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1 Q 57.75 58.8
3 D 78.27 78.43
4 T 36.20 37.2
5 D 102.40 100.3
7 D 83.60 83.3
8 D 78.27 78.0
10 Q 57.75 58.4
11 T 37.20 36.6
12 D 98.26 97.3
14 D 77.80 79.3
15 T 30.18 29.8
16 T 37.79 39.25
17 S 39.81 38.77
18 Q 22.05 18.53
19 S 140.59 139.35
20 D 126.67 119.05
21 T 32.31 37.03
22 S 76.45 74.3
24 D 47.90 44.3
25 T 34.70 24.7
26 D 80.81 72.27
28 S 165.70 166.27
30 D 114.90 113.6
31 S 145.03 165.85
32 Q 15.71 16.52
33 D 37.30 38.15
34 Q 21.60 21.0
35 Q 21.60 20.9
36 S 48.43 58.0
37 Q 21.79 10.3
38 S 87.34 91.95
40 S 211.60 209.1
41 Q 24.50 27.33
43 T 34.58 32.57
44 T 33.36 34.05
45 S 85.60 88.75
47 T 39.26 38.95
49 D 69.73 69.8
50 Q 18.23 18.5
52 D 69.73 68.9
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
53 Q 18.23 18.5
54 D 83.65 83.1
56 D 98.26 102.0
57 T 36.40 37.0
58 D 72.65 81.3
60 Q 56.70 57.0
61 D 71.64 76.1
63 D 73.57 72.9
64 Q 19.20 18.6





Report incorrect data
Copy molecule link
 
     

nmrshiftdb2 (V. 1.5, nmrshiftdb.nmr.uni-koeln.de, currently 5935 users, 15032479 since 2010-12-14 23:09:00.0) © NMRShiftDB project 2002-2010, © Stefan Kuhn 2010 - 2025.