Current usage is:
Registered Users: 2390
Structures: 271630
Spectra: Measured 68118, calculated 396582
Username:
Password:
Use cookies for persistant login
Create New Account
(Only necessary for
contributing data)
Forgot password?
Impressum
Problems 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 some stereoconfiguration:
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
hose_lotusv7
1
Q
7.13
8.52
2
T
30.19
28.6
3
S
38.94
39.32
4
T
24.35
41.33
5
S
90.51
92.77
6
S
168.44
168.57
9
Q
50.89
51.23
10
S
167.71
167.5
12
S
144.18
146.97
13
D
96.50
98.05
14
S
159.80
160.85
16
Q
55.20
55.2
17
D
104.80
104.5
18
D
121.50
122.4
19
S
130.73
138.17
20
S
55.14
56.2
21
T
43.25
46.0
22
T
50.84
50.9
24
T
49.69
52.0
25
D
52.89
56.45
27
D
56.89
62.39
28
D
69.18
72.02
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
Prediction 0
acd_lotusv7
1
Q
8.52
7.13
2
T
28.60
30.19
3
S
39.32
38.94
4
T
41.33
24.35
5
S
92.77
90.51
6
S
168.57
168.44
9
Q
51.23
50.89
10
S
167.50
167.71
12
S
146.97
144.18
13
D
98.05
96.5
14
S
160.85
159.8
16
Q
55.20
55.2
17
D
104.50
104.8
18
D
122.40
121.5
19
S
138.17
130.73
20
S
56.20
55.14
21
T
46.00
43.25
22
T
50.90
50.84
24
T
52.00
49.69
25
D
56.45
52.89
27
D
62.39
56.89
28
D
72.02
69.18
Report incorrect data
Copy molecule link
nmrshiftdb2 (V. 1.4.15, nmrshiftdb.nmr.uni-koeln.de, currently 246 users, 5165678 since 2010-12-14 23:09:00.0) ©
NMRShiftDB project
2002-2010, © Stefan Kuhn 2010 - 2019.
Credits