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Details
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This molecule without stereoconfiguration: This molecule with other stereoconfigurations:
General
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NMReDATA_chemie koeln_Classics in Spectroscopy/Dimethylsulphoxide-D6 (DMSO-D6, C2D6SO)
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Type: 1H 700.1500244140625 Double click to get resizeable window!
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Atom |
Mult.(coupling const.) |
Meas. Shift |
6'''-H
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1.07 (H 56, H 57, H 58) |
4''-H
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3.12 (H 45) |
4'''-H
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3.14 (H 51) |
2''-H
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3.21 (H 47) |
3''-H
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3.26 (H 46) |
3-H
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3.27 (H 68), 2.77 (H 69) |
5'''-H
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3.39 (H 55) |
3'''-H
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(2.2) |
3.42 (H 50) |
5''-H
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(1.9,8.3) |
3.53 (H 44) |
2'''-H
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3.62 (H 48) |
7'-H
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3.76 (H 75, H 76, H 77) |
6''-H
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3.79 (H 53), 3.42 (H 54) |
OH-3'''-H
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4.46 (H 63) |
1'''-H
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4.51 (H 49) |
OH-2'''-H
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4.59 (H 62) |
OH-4'''-H
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4.67 (H 64) |
1''-H
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4.96 (H 52) |
OH-3''-H
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5.15 (H 60) |
OH-4''-H
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5.17 (H 59) |
OH-2''-H
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5.38 (H 61) |
2-H
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DD (12.3,3.0) |
5.49 (H 67) |
8-H
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D (12.3) |
6.11 (H 65) |
6-H
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D (2.2,3.0) |
6.13 (H 66) |
6'-H
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DD |
6.89 (H 71) |
2'-H
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D (1.9) |
6.93 (H 70) |
5'-H
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D (8.3) |
6.93 (H 73) |
OH-3'-H
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9.08 (H 74) |
OH-5-H
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12.01 (H 72) |
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Show spectrum in full size
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Type: H,H-COSY 700.1500244140625 Double click to get resizeable window!
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Axis: 1 (H) |
Axis: 2 (H) |
Atom |
Shift |
Atom |
Shift |
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34
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2.77 |
34
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3.27 |
17
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3.12 |
16
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3.53 |
17
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3.12 |
18
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3.26 |
17
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3.12 |
4
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5.17 |
23
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3.14 |
22
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3.42 |
23
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3.14 |
10
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4.67 |
19
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3.21 |
7
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5.38 |
18
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3.26 |
6
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5.15 |
18
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3.26 |
19
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3.21 |
34
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3.27 |
33
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5.49 |
26
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3.39 |
27
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1.07 |
26
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3.39 |
23
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3.14 |
25
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3.42 |
25
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3.79 |
22
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3.42 |
9
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4.46 |
16
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3.53 |
25
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3.79 |
20
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3.62 |
8
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4.59 |
20
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3.62 |
21
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4.51 |
20
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3.62 |
22
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3.42 |
24
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4.96 |
19
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3.21 |
33
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5.49 |
34
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2.77 |
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Show spectrum in full size
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Type: H,C-HSQC 700.1500244140625 Double click to get resizeable window!
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Axis: 1 (H) |
Axis: 2 (C) |
Atom |
Shift |
Shift |
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27
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1.07 |
17.8 |
34
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2.77 |
42.1 |
17
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3.12 |
69.6 |
23
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3.14 |
72.1 |
19
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3.21 |
73.0 |
18
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3.26 |
76.3 |
34
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3.27 |
42.1 |
26
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3.39 |
68.4 |
25
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3.42 |
66.0 |
22
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3.42 |
70.8 |
16
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3.53 |
75.6 |
20
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3.62 |
70.3 |
43
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3.76 |
55.8 |
25
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3.79 |
66.0 |
21
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4.51 |
100.6 |
24
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4.96 |
99.5 |
33
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5.49 |
78.4 |
29
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6.11 |
95.5 |
31
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6.13 |
96.4 |
39
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6.89 |
118.0 |
38
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6.93 |
114.2 |
41
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6.93 |
112.1 |
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Show spectrum in full size
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Type: H,C-HMBC 700.1500244140625 Double click to get resizeable window!
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Axis: 1 (H) |
Axis: 2 (C) |
Atom |
Shift |
Atom |
Shift |
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27
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1.07 |
26
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68.4 |
27
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1.07 |
23
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72.1 |
34
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2.77 |
36
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197.0 |
34
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2.77 |
37
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131.0 |
34
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2.77 |
32
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103.3 |
17
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3.12 |
25
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66.0 |
23
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3.14 |
27
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17.8 |
23
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3.14 |
26
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68.4 |
23
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3.14 |
22
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70.8 |
19
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3.21 |
24
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99.5 |
19
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3.21 |
18
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76.3 |
34
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3.27 |
36
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197.0 |
34
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3.27 |
37
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131.0 |
26
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3.39 |
27
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17.8 |
26
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3.39 |
22
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70.8 |
26
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3.39 |
23
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72.1 |
25
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3.42 |
21
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100.6 |
25
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3.42 |
16
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75.6 |
16
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3.53 |
17
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69.6 |
16
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3.53 |
25
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66.0 |
16
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3.53 |
18
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76.3 |
16
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3.53 |
24
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99.5 |
20
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3.62 |
22
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70.8 |
20
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3.62 |
23
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72.1 |
20
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3.62 |
16
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75.6 |
43
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3.76 |
42
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148.0 |
25
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3.79 |
21
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100.6 |
25
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3.79 |
17
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69.6 |
25
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3.79 |
16
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75.6 |
9
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4.46 |
20
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70.3 |
9
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4.46 |
22
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70.8 |
21
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4.51 |
25
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66.0 |
21
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4.51 |
26
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68.4 |
21
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4.51 |
22
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70.8 |
8
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4.59 |
21
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100.6 |
8
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4.59 |
20
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70.3 |
10
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4.67 |
26
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68.4 |
10
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4.67 |
23
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72.1 |
24
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4.96 |
28
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165.2 |
24
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4.96 |
16
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75.6 |
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Axis: 1 (H) |
Axis: 2 (C) |
Atom |
Shift |
Atom |
Shift |
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6
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5.15 |
19
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73.0 |
6
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5.15 |
18
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76.3 |
4
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5.17 |
16
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75.6 |
4
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5.17 |
17
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69.6 |
7
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5.38 |
24
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99.5 |
7
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5.38 |
18
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76.3 |
7
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5.38 |
19
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73.0 |
33
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5.49 |
38
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114.2 |
33
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5.49 |
39
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118.0 |
33
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5.49 |
37
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131.0 |
33
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5.49 |
36
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197.0 |
33
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5.49 |
34
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42.1 |
33
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5.49 |
30
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162.5 |
29
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6.11 |
28
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165.2 |
29
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6.11 |
30
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162.5 |
29
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6.11 |
31
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96.4 |
29
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6.11 |
32
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103.3 |
29
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6.11 |
36
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197.0 |
31
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6.13 |
28
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165.2 |
31
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6.13 |
35
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163.0 |
31
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6.13 |
29
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95.5 |
31
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6.13 |
32
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103.3 |
39
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6.89 |
42
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148.0 |
39
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6.89 |
38
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114.2 |
39
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6.89 |
33
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78.4 |
41
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6.93 |
40
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146.5 |
38
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6.93 |
42
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148.0 |
38
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6.93 |
37
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131.0 |
38
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6.93 |
39
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118.0 |
38
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6.93 |
33
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78.4 |
15
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9.08 |
42
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148.0 |
15
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9.08 |
40
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146.5 |
15
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9.08 |
38
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114.2 |
12
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12.01 |
35
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163.0 |
12
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12.01 |
32
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103.3 |
12
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12.01 |
36
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197.0 |
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Show spectrum in full size
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Type: H,H-NOESY 700.1500244140625 Double click to get resizeable window!
|
|
Axis: 1 (H) |
Axis: 2 (H) |
Atom |
Shift |
Atom |
Shift |
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34
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2.77 |
34
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3.27 |
17
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3.12 |
4
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5.17 |
19
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3.21 |
7
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5.38 |
18
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3.26 |
7
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5.38 |
18
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3.26 |
4
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5.17 |
34
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3.27 |
38
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6.93 |
25
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3.42 |
25
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3.79 |
20
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3.62 |
8
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4.59 |
43
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3.76 |
41
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6.93 |
24
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4.96 |
31
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6.13 |
24
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4.96 |
29
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6.11 |
33
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5.49 |
38
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6.93 |
33
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5.49 |
39
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6.89 |
31
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6.13 |
12
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12.01 |
38
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6.93 |
15
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9.08 |
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Show spectrum in full size
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Type: APT 175.0 Double click to get resizeable window!
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Atom |
Mult.(coupling const.) |
Meas. Shift |
6'''
|
Q |
17.8 |
3
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T |
42.1 |
7'
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Q |
55.8 |
6''
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T |
66.0 |
5'''
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D |
68.4 |
4''
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D |
69.6 |
2'''
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D |
70.3 |
3'''
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D |
70.8 |
4'''
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D |
72.1 |
2''
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D |
73.0 |
5''
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D |
75.6 |
3''
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D |
76.3 |
2
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D |
78.4 |
1''
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D |
95.5 |
6
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D |
96.4 |
1''
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D |
99.5 |
1'''
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D |
100.6 |
10
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S |
103.3 |
5'
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D |
112.1 |
2'
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D |
114.2 |
6'
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D |
118.0 |
1'
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S |
131.0 |
3'
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S |
146.5 |
4'
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S |
148.0 |
9
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S |
162.5 |
5
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S |
163.0 |
7
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S |
165.2 |
4
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S |
197.0 |
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Show spectrum in full size
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