Current usage is:
Registered Users: 2392
Structures: 271631
Spectra: Measured 68119, 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
Spectral Data
Additional Data
Download
Type: 13C Unreported
Atom
Mult.(coupling const.)
Meas.
Shift
Prediction 0
acd_lotusv7
Prediction 1
hose_lotusv7
1
S
182.3
182.3
182.3
2
S
181.4
181.4
181.3
3
S
148.6
144.5
146.7
4
D
140.3
141.75
140.2
5
S
134.9
128.2
134.9
6
S
128.2
134.9
128.2
7
D
128.1
128.1
128.25
8
D
136.7
134.54
136.7
9
S
140.0
137.31
140.0
10
S
144.6
140.0
144.6
11
D
26.9
26.9
26.85
12
Q
21.5
21.5
21.45
13
Q
21.5
21.5
21.45
14
Q
19.8
19.8
19.8
15
T
30.6
30.6
30.6
16
T
23.8
23.8
23.8
17
T
44.2
44.2
44.2
18
S
71.1
71.1
71.1
19
Q
29.2
29.2
29.2
20
Q
29.2
29.2
29.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
hose_lotusv7
1
S
182.30
182.3
182.3
2
S
181.40
181.4
181.3
3
S
144.50
148.6
146.7
4
D
141.75
140.3
140.2
5
S
128.20
134.9
134.9
6
S
134.90
128.2
128.2
7
D
128.10
128.1
128.25
8
D
134.54
136.7
136.7
9
S
137.31
140.0
140.0
10
S
140.00
144.6
144.6
11
D
26.90
26.9
26.85
12
Q
21.50
21.5
21.45
13
Q
21.50
21.5
21.45
14
Q
19.80
19.8
19.8
15
T
30.60
30.6
30.6
16
T
23.80
23.8
23.8
17
T
44.20
44.2
44.2
18
S
71.10
71.1
71.1
19
Q
29.20
29.2
29.2
20
Q
29.20
29.2
29.2
Spectral Data
Additional Data
Download
Type: 13C
Atom
Mult.(coupling const.)
Prediction
Shift
expt-0
ocmainz inhouse-2
Prediction 1
acd_lotusv7
1
S
182.30
182.3
182.3
2
S
181.30
181.4
181.4
3
S
146.70
148.6
144.5
4
D
140.20
140.3
141.75
5
S
134.90
134.9
128.2
6
S
128.20
128.2
134.9
7
D
128.25
128.1
128.1
8
D
136.70
136.7
134.54
9
S
140.00
140.0
137.31
10
S
144.60
144.6
140.0
11
D
26.85
26.9
26.9
12
Q
21.45
21.5
21.5
13
Q
21.45
21.5
21.5
14
Q
19.80
19.8
19.8
15
T
30.60
30.6
30.6
16
T
23.80
23.8
23.8
17
T
44.20
44.2
44.2
18
S
71.10
71.1
71.1
19
Q
29.20
29.2
29.2
20
Q
29.20
29.2
29.2
Report incorrect data
Copy molecule link
nmrshiftdb2 (V. 1.4.15, nmrshiftdb.nmr.uni-koeln.de, currently 1359 users, 5179988 since 2010-12-14 23:09:00.0) ©
NMRShiftDB project
2002-2010, © Stefan Kuhn 2010 - 2019.
Credits