Home
Current usage is:
Registered Users: 1409
Structures: 43482
Spectra: Measured 52223, calculated 549
Username:
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 104.96 104.61
2 D 80.96 80.53
3 D 84.69 83.9
4 D 75.39 74.72
5 D 72.74 73.06
6 T 70.49 70.75
7 Q 55.03 56.75
8 Q 59.46 60.72
9 Q 58.19 58.26
10 Q 59.97 61.22
11 Q 58.04 59.29

Show spectrum in full size

Spectral Data   Additional Data   Download  
Type: 1H 500.1300048828125
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
expt-0
chemie koeln
expt-1
chemie koeln
1-H 4.0 4.174.35
2-H 3.26 3.333.2
3-H 2.99 3.163.46
4-H 3.52 3.673.9
5-H 3.36 3.53.78
6-H 3.58, 3.36 3.653.71
7-H 3.40 3.533.57
8-H 3.49 3.613.56
9-H 3.47 3.543.52
10-H 3.49 3.583.52
11-H 3.32 3.433.43

Show spectrum in full size

Spectral Data   Additional Data   Download  
Type: H,H-COSY 600.1599731445312
Axis: 1 (H)
Axis: 2 (H)
Atom
Shift
Atom
Shift
3 2.99 2 3.26
2 3.26 1 4.0
6 3.58 5 3.36

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 2.99 84.69
2 3.26 80.96
11 3.32 58.04
5 3.36 72.74
6 3.36 70.49
7 3.4 55.03
9 3.47 58.19
8 3.49 59.46
10 3.49 59.97
4 3.52 75.39
6 3.58 70.49
1 4.0 104.96

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
3 2.99 2 80.96
2 3.26 1 104.96
2 3.26 3 84.69
2 3.26 8 59.46
11 3.32 6 70.49
6 3.36 4 75.39
5 3.36 6 70.49
6 3.36 5 72.74
5 3.36 1 104.96
7 3.4 1 104.96
9 3.47 3 84.69
10 3.49 4 75.39
4 3.52 10 59.97
6 3.58 4 75.39
6 3.58 5 72.74
1 4.0 7 55.03

Show spectrum in full size


Report incorrect data
Copy dataset link
Get this dataset as file
Copy molecule link
 
     


nmrshiftdb2 (V. 1.4.14, nmrshiftdb.nmr.uni-koeln.de, currently 14 users, 1964008 since 2010-12-14 23:09:00.0) © NMRShiftDB project 2002-2010, © Stefan Kuhn 2010 - 2019.