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This molecule with other stereoconfigurations:
Type: 13C 125.03250122070312
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|
Atom |
Mult.(coupling const.) |
Meas. Shift |
| expt-0 chemie koeln | expt-1 chemie koeln |
1
|
D |
104.44 |
| 104.08 | 103.14 |
2
|
D |
84.16 |
| 83.45 | 82.15 |
3
|
D |
86.61 |
| 86.63 | 84.81 |
4
|
D |
78.97 |
| 79.44 | 78.98 |
5
|
D |
75.14 |
| 74.49 | 73.29 |
6
|
T |
71.42 |
| 71.23 | 70.41 |
7
|
Q |
55.22 |
| 56.93 | 57.19 |
8
|
Q |
59.23 |
| 60.48 | 59.99 |
9
|
Q |
59.86 |
| 60.86 | 59.99 |
10
|
Q |
59.36 |
| 60.34 | 59.97 |
11
|
Q |
58.39 |
| 59.34 | 58.26 |
|
Show spectrum in full size
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Type: 1H 500.13
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|
Atom |
Mult.(coupling const.) |
Meas. Shift |
| expt-0 chemie koeln | expt-1 chemie koeln |
1-H
|
|
4.01 |
| 4.38 | 4.16 |
2-H
|
|
2.87 |
| 3.06 | 3.01 |
3-H
|
|
3.03 |
| 3.39 | 3.18 |
4-H
|
|
3.07 |
| 3.24 | 3.16 |
5-H
|
|
3.14 |
| 3.51 | 3.29 |
6-H
|
|
3.56, 3.51 |
Spectral Data
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Additional Data
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Download
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Type: 13C Unreported Double click to get resizeable window!
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|
Atom |
Mult.(coupling const.) |
Meas. Shift |
Intensity |
| expt-0
| expt-1 Chemikalienlager Uni Mainz |
1
|
S |
151.5 |
0.336 |
| 151.8 | 153.502 |
2
|
S |
120.2 |
0.084 |
| 120.3 | 120.042 |
3
|
D |
129.2 |
0.689 |
| 129.3 | 130.307 |
4
|
D |
121.5 |
0.725 |
| 121.5 | 120.445 |
5
|
D |
128.4 |
1.0 |
| 128.5 | 128.473 |
6
|
D |
116.5 |
0.971 |
| 116.3 | 117.103 |
|
Double click upper part to get resizeable window!
|
Type: 1H Unreported Double click to get resizeable window!
|
|
Atom |
Mult.(coupling const.) |
Meas. Shift |
3-H
|
|
7.287 |
4-H
|
|
6.853 |
5-H
|
|
7.159 |
6-H
|
|
7.010 |
7-H
|
|
5.610 |
|
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ules/large/60004029_60002292.jpeg">
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|
Axis: 1 (H) |
Axis: 2 (C) |
Atom |
Shift |
Atom |
Shift |
|
2
|
2.87 |
1
|
104.44 |
2
|
2.87 |
3
|
86.61 |
3
|
3.03 |
4
|
78.97 |
3
|
3.03 |
9
|
59.86 |
4
|
3.07 |
6
|
71.42 |
4
|
3.07 |
5
|
75.14 |
4
|
3.07 |
3
|
86.61 |
5
|
3.14 |
4
|
78.97 |
11
|
3.35 |
6
|
71.42 |
7
|
3.42 |
1
|
104.44 |
10
|
3.48 |
4
|
78.97 |
8
|
3.49 |
2
|
84.16 |
6
|
3.51 |
11
|
58.39 |
6
|
3.56 |
11
|
58.39 |
9
|
3.57 |
3
|
86.61 |
1
|
4.01 |
7
|
55.22 |
1
|
4.01 |
5
|
75.14 |
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