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This molecule with other stereoconfigurations:


NMReDATA_chemie koeln_Classics in Spectroscopy/Deuteriumoxide (D2O)  
Spectral Data   Additional Data   Download  
Type: 1H 700.1500244140625
Atom
Mult.(coupling const.)
Meas.
Shift
2-H (1.8,1.9,4.2) 6.81
4-H (8.4,4.4) 3.76
5-H (8.4,5.3,6.5) 4.02
3-H (4.2,1.3,1.3,4.4) 4.44
6-H (18.1,1.8,5.3,1.3); (18.1,1.9,6.5,1.3) 2.73 (H 13), 2.22 (H 14)
8-H
9-H
10-H
11-H

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Spectral Data   Additional Data   Download  
Type: H,H-COSY 700.1500244140625
Axis: 1 (H)
Axis: 2 (H)
Atom
Shift
Atom
Shift
7 2.22 7 2.73
5 4.02 4 3.76
7 2.73 5 4.02
7 2.22 5 4.02
2 6.81 6 4.44
4 3.76 6 4.44

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Spectral Data   Additional Data   Download  
Type: H,C-HSQC 700.1500244140625
Axis: 1 (H)
Axis: 2 (C)
Atom
Shift
Shift
2 6.81 139.93
4 3.76 73.74
5 4.02 69.0
6 4.44 68.3
7 2.73 33.1
7 2.22 33.1

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Spectral Data   Additional Data   Download  
Type: H,C-HMBC 700.1500244140625
Axis: 1 (H)
Axis: 2 (C)
Atom
Shift
Atom
Shift
2 6.81 1 172.85
7 2.73 1 172.85
7 2.22 1 172.85
6 4.44 2 139.93
4 3.76 2 139.93
7 2.73 2 139.93
7 2.22 2 139.93
6 4.44 3 132.35
5 4.02 3 132.35
7 2.73 3 132.35
7 2.22 3 132.35
2 6.81 4 73.74
6 4.44 4 73.74
5 4.02 4 73.74
7 2.73 4 73.74
7 2.22 4 73.74
6 4.44 5 69.0
4 3.76 5 69.0
7 2.73 5 69.0
7 2.22 5 69.0
5 4.02 6 68.3
2 6.81 7 33.1
4 3.76 7 33.1

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Spectral Data   Additional Data   Download  
Type: H,H-NOESY 700.1500244140625
Axis: 1 (H)
Axis: 2 (H)
Atom
Shift
Atom
Shift
5 4.02 7 2.73
7 2.73 7 2.22
6 4.44 2 6.81
7 2.22 4 3.76
6 4.44 4 3.76
4 3.76 5 4.02

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Spectral Data   Additional Data   Download  
Type: APT 176.0528564453125
Atom
Mult.(coupling const.)
Meas.
Shift
7 S 172.85
2 D 139.93
1 S 132.35
4 D 73.74
5 D 69.00
3 D 68.30
6 T 33.10

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