Home
Current usage is:
Registered Users: 1274
Structures: 43465
Spectra: Measured 52169, calculated 549
Username:

Logon with SSL
Password:
Use cookies for persistant login
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:


chemie koeln/Chloroform-D1 (CDCl3)   chemie koeln/Cyclohexane   chemie koeln/Deuteriumoxide (D2O)  
Spectral Data   Additional Data   Download  
Type: 13C 37.5
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
expt-0
chemie koeln
1 D 104.61 104.96
2 D 80.53 80.96
3 D 83.90 84.69
4 D 74.72 75.39
5 D 73.06 72.74
6 T 70.75 70.49
7 Q 56.75 55.03
8 Q 60.72 59.46
9 Q 58.26 58.19
10 Q 61.22 59.97
11 Q 59.29 58.04

Show spectrum in full size

Spectral Data   Additional Data   Download  
Type: 1H 500.13
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
expt-0
chemie koeln
expt-1
chemie koeln
1-H 4.17 4.04.35
10-H 3.58 3.493.52
11-H 3.43 3.323.43
2-H 3.33 3.263.2
3-H 3.16 2.993.46
4-H 3.67 3.523.9
5-H 3.50 3.363.78
6-H 3.65, 3.56 3.583.71
7-H 3.53 3.43.57
8-H 3.61 3.493.56
9-H 3.54 3.473.52

Show spectrum in full size

Spectral Data   Additional Data   Download  
Type: H,H-COSY 500.1300048828125
Axis: 1 (H)
Axis: 2 (H)
Atom
Shift
Atom
Shift
3 3.16 4 3.67
2 3.33 1 4.17
2 3.33 3 3.16
6 3.65 5 3.5
6 3.65 6 3.56

Show spectrum in full size

Spectral Data   Additional Data   Download  
Type: H,C-HSQC 150.0
Axis: 1 (H)
Axis: 2 (C)
Atom
Shift
Shift
3 3.16 83.9
2 3.33 80.53
11 3.43 59.29
5 3.5 73.06
7 3.53 56.75
9 3.54 58.26
6 3.56 70.75
10 3.58 61.22
8 3.61 60.72
6 3.65 70.75
4 3.67 74.72
1 4.17 104.61

Show spectrum in full size

Spectral Data   Additional Data   Download  
Type: H,C-HMBC 500.1300048828125
Axis: 1 (H)
Axis: 2 (C)
Atom
Shift
Atom
Shift
2 3.33 1 104.61
2 3.33 8 60.72
11 3.43 6 70.75
5 3.5 1 104.61
5 3.5 6 70.75
7 3.53 1 104.61
9 3.54 3 83.9
6 3.56 11 59.29
10 3.58 4 74.72
8 3.61 2 80.53
6 3.65 5 73.06
6 3.65 11 59.29
4 3.67 3 83.9
4 3.67 2 80.53
4 3.67 10 61.22
1 4.17 2 80.53
1 4.17 7 56.75
1 4.17 5 73.06

Show spectrum in full size


Report incorrect data
Copy dataset link
Copy molecule link
 
     


nmrshiftdb2 (V. 1.4.13 nmrshiftdb.nmr.uni-koeln.de, currently 224 users, 1865666 since 2010-12-14 23:09:00.0) © NMRShiftDB project 2002-2010, © Stefan Kuhn 2010 - 2017.