Average chemical shift: 17.123
Standard deviation: 1.73
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
397 | 7 | CE | 32.1 | 1 |
1734 | 61 | CE | 68.1 | 1 |
4001 | 58 | CE | 39.44 | 1 |
4048 | 40 | CE | 40.00 | 1 |
4064 | 136 | CE | 32.2 | 1 |
4064 | 60 | CE | 37.2 | 1 |
4082 | 113 | CE | 35.1 | 1 |
4082 | 85 | CE | 37.4 | 1 |
4150 | 86 | CE | 56.195 | |
4153 | 69 | CE | 48.07 | 1 |
4153 | 71 | CE | 48.46 | 1 |
4317 | 1 | CE | 27.2 | 1 |
4590 | 60 | CE | 53.60 | 1 |
4717 | 74 | CE | 25.90 | |
4953 | 77 | CE | 22.504 | 1 |
5018 | 1 | CE | 24.1900 | |
5179 | 16 | CE | 66.680 | |
5386 | 80 | CE | 41.37 | 1 |
5407 | 65 | CE | 30.986 | |
5407 | 71 | CE | 26.548 | |
5678 | 65 | CE | 22.35 | 1 |
5683 | 77 | CE | 40.771 | |
5748 | 23 | CE | 26.440 | 1 |
5819 | 128 | CE | 25.8 | 9 |
5904 | 81 | CE | 27.2 | 1 |
5906 | 27 | CE | 22.9 | 1 |
5920 | 66 | CE | 26.7120 | 1 |
5982 | 19 | CE | 29.870 | |
6255 | 103 | CE | 38.441 | 1 |
6255 | 115 | CE | 38.440 | 1 |
6255 | 54 | CE | 37.723 | 1 |
6312 | 81 | CE | 22.481 | 1 |
6330 | 6 | CE | 40.1 | 1 |
6519 | 57 | CE | 42.565 | 1 |
6725 | 13 | CE | 22.52 | 1 |
7059 | 175 | CE | 23.331 | 1 |
7180 | 74 | CE | 45.3 | 1 |
7286 | 1 | CE | 23.573 | 1 |
7350 | 1 | CE | 71.156 | |
7350 | 3 | CE | 71.156 | |
7381 | 78 | CE | 22.692 | 1 |
11031 | 28 | CE | 26.85 | 1 |
15172 | 1 | CE | 25.3 | 5 |
15401 | 78 | CE | 22.692 | 1 |
15402 | 78 | CE | 22.692 | 1 |
15545 | 52 | CE | 24.876 | |
15689 | 9 | CE | 27.010 | 1 |
15836 | 48 | CE | 44.1 | 1 |
15961 | 24 | CE | 23.56 | 1 |
16061 | 111 | CE | 26.430 | 1 |
16063 | 1 | CE | 26.7400 | 1 |
16063 | 52 | CE | 30.0000 | 1 |
16174 | 1 | CE | 24.503 | 1 |
16213 | 122 | CE | 27.935 | 1 |
16213 | 151 | CE | 27.466 | 1 |
16312 | 1 | CE | 24.7 | 1 |
16712 | 37 | CE | 24.258 | 1 |
16712 | 65 | CE | 26.533 | 1 |
16797 | 19 | CE | 27.286 | 1 |
16856 | 5 | CE | 25.861 | |
16914 | 58 | CE | 25.156 | 1 |
17067 | 102 | CE | 47.9 | 1 |
17067 | 98 | CE | 39.3 | 1 |
17254 | 1 | CE | 24.553 | 1 |
17254 | 87 | CE | 23.105 | 1 |
17255 | 1 | CE | 24.605 | 1 |
17255 | 87 | CE | 22.950 | 1 |
17274 | 81 | CE | 24.990 | 1 |
17717 | 216 | CE | 28.030 | 1 |
17855 | 31 | CE | 24.141 | 1 |
17855 | 58 | CE | 26.769 | 1 |
17855 | 77 | CE | 24.198 | 1 |
18197 | 34 | CE | 25.305 | 1 |
18197 | 35 | CE | 24.928 | 1 |
18290 | 45 | CE | 22.320 | 1 |
18379 | 81 | CE | 24.990 | 1 |
18399 | 76 | CE | 27.061 | 1 |
18578 | 82 | CE | 25.470 | 1 |
19148 | 15 | CE | 32.013 | |
19395 | 124 | CE | 27.037 | |
19854 | 89 | CE | 27.925 | 1 |
19961 | 33 | CE | 87.600 | 1 |
19961 | 67 | CE | 88.200 | 1 |
19994 | 55 | CE | 46.350 | |
19994 | 62 | CE | 47.515 | |
19994 | 8 | CE | 46.350 | |
21010 | 19 | CE | 38.949 | 1 |
21010 | 2 | CE | 38.949 | 1 |
25160 | 97 | CE | 24.5940 | 1 |
25382 | 21 | CE | 72.483 | |
25382 | 60 | CE | 73.323 | |
25382 | 66 | CE | 73.043 | |
25442 | 13 | CE | 317.645 | |
25664 | 1 | CE | 86.665 | 1 |
25666 | 1 | CE | 86.665 | 1 |
26552 | 163 | CE | 32.500 | |
26552 | 167 | CE | 49.7167 | |
26552 | 56 | CE | 50.4767 | |
26725 | 66 | CE | 28.927 | |
27666 | 74 | CE | 27.273 | 1 |
30070 | 22 | CE | 26.297 | 1 |
30303 | 68 | CE | 25.993 | |
34022 | 138 | CE | 32.500 | |
34022 | 142 | CE | 49.7167 | |
34022 | 31 | CE | 50.4767 | |
34216 | 115 | CE | 47.465 | |
34480 | 15 | CE | 32.280 | 1 |
34480 | 33 | CE | 33.560 | 1 |
34480 | 60 | CE | 25.721 | 1 |
50153 | 5 | CE | 36.565 | 1 |
50153 | 9 | CE | 36.547 | 1 |
50550 | 70 | CE | 27.2 | 1 |
52006 | 35 | CE | 23.303 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4431 | 13 | CE | 9.5 | 1 |
4578 | 61 | CE | 8.90 | 1 |
4679 | 137 | CE | 11.5000 | |
6692 | 72 | CE | 11.374 | 1 |
7359 | 85 | CE | 10.683 | 1 |
7360 | 85 | CE | 10.690 | 1 |
11084 | 105 | CE | 11.857 | 1 |
11086 | 92 | CE | 11.655 | 1 |
15361 | 132 | CE | 10.809 | 1 |
19431 | 107 | CE | 11.740 | 1 |
19814 | 6 | CE | 0.000 | 1 |
25342 | 20 | CE | 11.631 | 1 |
25567 | 20 | CE | 11.607 | |
26812 | 44 | CE | 10.5 | 1 |
27467 | 38 | CE | 9.752 | |
27467 | 64 | CE | 9.697 | |
27467 | 65 | CE | 9.787 | |
27857 | 87 | CE | 10.4 | 1 |
30133 | 69 | CE | 9.930 | 9 |
31028 | 11 | CE | 0.507 | 1 |
34480 | 84 | CE | 9.661 | 1 |
50024 | 391 | CE | 11.813 | |
50299 | 16 | CE | 10.387 |