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/Cyclohexane   chemie koeln/Deuteriumoxide (D2O)   chemie koeln/Chloroform-D1 (CDCl3)  
Spectral Data   Additional Data   Download  
Type: 13C 37.5
Atom
No. ⇓
Mult.(coupling const.)
Meas.
Shift
expt-0
chemie koeln
expt-1
chemie koeln
1 D 104.08 103.14104.44
2 D 83.45 82.1584.16
3 D 86.63 84.8186.61
4 D 79.44 78.9878.97
5 D 74.49 73.2975.14
6 T 71.23 70.4171.42
7 Q 56.93 57.1955.22
8 Q 60.48 59.9959.23
9 Q 60.86 59.9959.86
10 Q 60.34 59.9759.36
11 Q 59.34 58.2658.39

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 4.16 4.384.01
2-H 3.01 3.062.87
3-H 3.18 3.393.03
4-H 3.16 3.243.07
5-H 3.29 3.513.14
6-H 3.66, 3.58 3.733.56
7-H 3.54 3.553.42
8-H 3.59 3.573.49
9-H 3.64 3.633.57
10-H 3.55 3.543.48
11-H 3.43 3.413.35

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
2 3.01 1 4.16
3 3.18 2 3.01
5 3.29 4 3.16
6 3.58 5 3.29
6 3.66 6 3.58

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
2 3.01 83.45
4 3.16 79.44
3 3.18 86.63
5 3.29 74.49
11 3.43 59.34
7 3.54 56.93
10 3.55 60.34
6 3.58 71.23
8 3.59 60.48
9 3.64 60.86
6 3.66 71.23
1 4.16 104.08

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 3.01 1 104.08
4 3.16 5 74.49
5 3.29 4 79.44
11 3.43 6 71.23
7 3.54 1 104.08
10 3.55 4 79.44
8 3.59 2 83.45
9 3.64 3 86.63
6 3.66 5 74.49
6 3.66 4 79.44
6 3.66 11 59.34
1 4.16 7 56.93

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, 1964053 since 2010-12-14 23:09:00.0) © NMRShiftDB project 2002-2010, © Stefan Kuhn 2010 - 2019.