Average chemical shift: 24.131
Standard deviation: 2.082
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4150 | 12 | CD2 | 63.704 | |
4150 | 20 | CD2 | 64.257 | |
4150 | 24 | CD2 | 62.782 | |
4150 | 26 | CD2 | 64.564 | |
4150 | 39 | CD2 | 63.537 | |
4150 | 73 | CD2 | 59.539 | |
4649 | 78 | CD2 | 64.9220 | |
4995 | 17 | CD2 | 30.4 | 2 |
4995 | 7 | CD2 | 30.4 | 2 |
5179 | 11 | CD2 | 71.180 | |
5179 | 13 | CD2 | 73.480 | |
5179 | 36 | CD2 | 71.980 | |
5179 | 38 | CD2 | 72.980 | |
5179 | 46 | CD2 | 73.280 | |
5631 | 23 | CD2 | 60.60 | 1 |
5631 | 59 | CD2 | 58.40 | 1 |
5631 | 60 | CD2 | 60.10 | 1 |
5631 | 8 | CD2 | 59.50 | 1 |
5631 | 85 | CD2 | 57.80 | 1 |
5631 | 86 | CD2 | 58.40 | 1 |
5631 | 95 | CD2 | 61.20 | 1 |
5791 | 6 | CD2 | 41.770 | 1 |
11055 | 72 | CD2 | 116.300 | 2 |
15873 | 12 | CD2 | 45.573 | 1 |
15873 | 15 | CD2 | 40.921 | 1 |
15873 | 16 | CD2 | 44.867 | 1 |
15873 | 20 | CD2 | 43.779 | 1 |
15873 | 27 | CD2 | 41.726 | 1 |
15873 | 29 | CD2 | 43.560 | 1 |
15873 | 33 | CD2 | 43.788 | 1 |
15873 | 42 | CD2 | 43.180 | 1 |
15873 | 52 | CD2 | 41.434 | 1 |
15873 | 60 | CD2 | 45.483 | 1 |
15873 | 66 | CD2 | 42.593 | 1 |
15874 | 12 | CD2 | 45.573 | 1 |
15874 | 15 | CD2 | 40.921 | 1 |
15874 | 16 | CD2 | 44.867 | 1 |
15874 | 20 | CD2 | 43.779 | 1 |
15874 | 27 | CD2 | 41.726 | 1 |
15874 | 29 | CD2 | 43.560 | 1 |
15874 | 33 | CD2 | 43.788 | 1 |
15874 | 42 | CD2 | 43.180 | 1 |
15874 | 52 | CD2 | 41.434 | 1 |
15874 | 60 | CD2 | 45.483 | 1 |
15874 | 66 | CD2 | 42.593 | 1 |
15877 | 11 | CD2 | 52.534 | 2 |
18340 | 14 | CD2 | 55.0153 | 1 |
18340 | 8 | CD2 | 55.1355 | 1 |
18951 | 17 | CD2 | 49.295 | 1 |
18951 | 20 | CD2 | 49.845 | 1 |
18951 | 26 | CD2 | 50.375 | 1 |
18951 | 3 | CD2 | 49.795 | 1 |
18951 | 40 | CD2 | 52.035 | 1 |
18951 | 42 | CD2 | 49.295 | 1 |
18951 | 43 | CD2 | 49.915 | 1 |
19716 | 23 | CD2 | 51.1998 | 2 |
19994 | 5 | CD2 | 54.736 | |
25382 | 24 | CD2 | 50.938 | |
25382 | 33 | CD2 | 50.814 | |
25382 | 47 | CD2 | 50.272 | |
25382 | 59 | CD2 | 51.449 | |
25382 | 73 | CD2 | 50.995 | |
25382 | 84 | CD2 | 50.417 | |
26552 | 107 | CD2 | 56.6717 | |
26552 | 110 | CD2 | 54.3277 | |
26552 | 126 | CD2 | 55.2427 | |
26552 | 158 | CD2 | 56.6127 | |
26552 | 32 | CD2 | 55.3807 | |
26552 | 42 | CD2 | 54.7887 | |
26552 | 55 | CD2 | 55.7867 | |
26552 | 78 | CD2 | 55.7037 | |
26552 | 82 | CD2 | 57.6977 | |
26552 | 88 | CD2 | 54.6087 | |
26593 | 93 | CD2 | 50.34 | 2 |
28131 | 21 | CD2 | 40.46 | |
30133 | 35 | CD2 | 31.339 | 9 |
30446 | 4 | CD2 | 32.515 | |
30447 | 4 | CD2 | 32.515 | |
34022 | 101 | CD2 | 55.2427 | |
34022 | 133 | CD2 | 56.6127 | |
34022 | 17 | CD2 | 54.7887 | |
34022 | 30 | CD2 | 55.7867 | |
34022 | 53 | CD2 | 55.7037 | |
34022 | 57 | CD2 | 57.6977 | |
34022 | 63 | CD2 | 54.6087 | |
34022 | 7 | CD2 | 55.3807 | |
34022 | 82 | CD2 | 56.6717 | |
34022 | 85 | CD2 | 54.3277 | |
50022 | 114 | CD2 | 41.227 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
1975 | 75 | CD2 | 16.99 | 1 |
1977 | 75 | CD2 | 16.91 | 1 |
4136 | 20 | CD2 | 17.30 | 2 |
4317 | 69 | CD2 | 16.0 | 2 |
4330 | 158 | CD2 | 17.121 | |
4431 | 40 | CD2 | 14.2 | 2 |
4431 | 42 | CD2 | 12.5 | 2 |
4431 | 56 | CD2 | 16.4 | 2 |
4431 | 96 | CD2 | 14.5 | 2 |
4448 | 80 | CD2 | 6.0 | 1 |
4583 | 21 | CD2 | 17.45 | |
4839 | 33 | CD2 | 13.59 | 9 |
4953 | 49 | CD2 | 14.900 | 1 |
5000 | 7 | CD2 | 17.02 | 1 |
5225 | 20 | CD2 | 17.31 | 2 |
5312 | 66 | CD2 | 16.4 | 2 |
5377 | 12 | CD2 | 12.95 | 2 |
5755 | 20 | CD2 | 17.00 | 1 |
5866 | 82 | CD2 | 16.4 | 2 |
5983 | 123 | CD2 | 15.90 | 1 |
6114 | 101 | CD2 | 17.0 | 1 |
6125 | 47 | CD2 | 17.7 | 1 |
6531 | 9 | CD2 | 14.440 | |
6727 | 31 | CD2 | 12.946 | 2 |
6944 | 98 | CD2 | 16.988 | |
7019 | 28 | CD2 | 17.216 | 1 |
10260 | 68 | CD2 | 17.550 | 2 |
11034 | 26 | CD2 | 17.448 | 1 |
11034 | 55 | CD2 | 9.860 | 1 |
11127 | 83 | CD2 | 17.773 | 2 |
11128 | 76 | CD2 | 17.814 | 2 |
11175 | 58 | CD2 | 17.600 | 1 |
15487 | 54 | CD2 | 11.706 | |
15487 | 87 | CD2 | 15.196 | |
15813 | 99 | CD2 | 16.975 | 2 |
15912 | 100 | CD2 | 17.74 | 1 |
15912 | 100 | CD2 | 17.78 | 1 |
15949 | 85 | CD2 | 16.806 | |
16114 | 59 | CD2 | 17.057 | 2 |
16115 | 127 | CD2 | 13.187 | 2 |
16534 | 100 | CD2 | 17.722 | 1 |
16534 | 46 | CD2 | 0.622 | 1 |
16597 | 2 | CD2 | 15.6 | 2 |
16809 | 98 | CD2 | 17.74 | 1 |
16809 | 98 | CD2 | 17.78 | 1 |
16884 | 51 | CD2 | 17.4 | 1 |
16971 | 53 | CD2 | 17.13 | 1 |
17009 | 62 | CD2 | 15.247 | 2 |
17067 | 108 | CD2 | 14.1 | 1 |
17067 | 60 | CD2 | 6.8 | 1 |
17425 | 45 | CD2 | 15.1575 | 1 |
17576 | 152 | CD2 | 13.212 | 2 |
17582 | 152 | CD2 | 13.420 | 2 |
17900 | 30 | CD2 | 17.282 | 1 |
18027 | 39 | CD2 | 17.031 | 1 |
18388 | 17 | CD2 | 11.493 | 2 |
18435 | 105 | CD2 | 14.86 | 1 |
18692 | 17 | CD2 | 14.8000 | 1 |
18982 | 11 | CD2 | 0.280 | 1 |
18982 | 7 | CD2 | 0.471 | 1 |
19400 | 66 | CD2 | 17.0984 | 2 |
19586 | 116 | CD2 | 16.482 | 1 |
19664 | 185 | CD2 | 17.266 | 1 |
19737 | 21 | CD2 | 5.973 | 1 |
19858 | 62 | CD2 | 16.500 | 1 |
25132 | 121 | CD2 | 17.604 | 1 |
25157 | 102 | CD2 | 15.8 | 2 |
25379 | 33 | CD2 | 16.996 | 1 |
25379 | 92 | CD2 | 16.938 | 1 |
25681 | 26 | CD2 | 2.058 | |
25681 | 36 | CD2 | 1.363 | |
25760 | 79 | CD2 | 17.232 | |
26012 | 177 | CD2 | 10.193 | |
26689 | 44 | CD2 | 15.793 | |
26805 | 174 | CD2 | 17.786 | |
27055 | 11 | CD2 | 11.810 | |
27059 | 268 | CD2 | 17.200 | |
28101 | 84 | CD2 | 15.868 | |
28132 | 79 | CD2 | 17.305 | |
30133 | 178 | CD2 | 14.626 | 9 |
30133 | 23 | CD2 | 17.448 | 9 |
30133 | 84 | CD2 | 11.765 | 9 |
30676 | 36 | CD2 | 16.225 | |
30925 | 36 | CD2 | 16.225 | |
31030 | 3 | CD2 | 17.530 | 2 |
34131 | 60 | CD2 | 13.167 | 1 |
34520 | 31 | CD2 | 17.5 | 1 |
34811 | 27 | CD2 | 12.836 | 1 |
36048 | 89 | CD2 | 16.870 | |
50283 | 107 | CD2 | 8.1807800 | |
50284 | 107 | CD2 | 8.1765930 | |
50285 | 107 | CD2 | 8.2117010 | |
50299 | 13 | CD2 | 17.819 | |
51313 | 64 | CD2 | 17.718 | 2 |
51495 | 93 | CD2 | 12.517 | 1 |