Average chemical shift: 117.736
Standard deviation: 4.062
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
447 | 98 | CE1 | 131.6 | 1 |
4267 | 101 | CE1 | 132.9 | 1 |
4267 | 65 | CE1 | 131.7 | 1 |
4405 | 75 | CE1 | 133.23 | 1 |
4405 | 84 | CE1 | 133.31 | 1 |
4706 | 139 | CE1 | 141.104 | 1 |
4789 | 66 | CE1 | 159.567 | 2 |
4818 | 98 | CE1 | 133.00 | 3 |
4952 | 65 | CE1 | 131.17 | 1 |
5337 | 61 | CE1 | 137.35 | 3 |
5532 | 80 | CE1 | 133.197 | 1 |
5631 | 72 | CE1 | 154.10 | 1 |
6571 | 71 | CE1 | 137.420 | 3 |
6629 | 14 | CE1 | 132.3 | 1 |
6629 | 9 | CE1 | 130.4 | 1 |
6779 | 14 | CE1 | 132.377 | |
6779 | 9 | CE1 | 130.550 | |
6837 | 117 | CE1 | 133.224 | |
7190 | 54 | CE1 | 134.009 | 1 |
11149 | 39 | CE1 | 132.180 | 3 |
15325 | 5 | CE1 | 133.4140 | |
15530 | 27 | CE1 | 132.21 | 1 |
15813 | 97 | CE1 | 132.1 | |
16449 | 3 | CE1 | 134.400 | |
16544 | 47 | CE1 | 130.300 | 1 |
17076 | 76 | CE1 | 130.260 | 3 |
17109 | 31 | CE1 | 131.038 | 3 |
17109 | 93 | CE1 | 135.823 | 3 |
18152 | 31 | CE1 | 131.038 | 3 |
18356 | 122 | CE1 | 134.5 | 1 |
18356 | 162 | CE1 | 134.4 | 1 |
18435 | 128 | CE1 | 130.7 | 3 |
18462 | 79 | CE1 | 131.419 | 1 |
18620 | 28 | CE1 | 132.8 | 1 |
18620 | 5 | CE1 | 133.0 | 1 |
18620 | 74 | CE1 | 130.6 | 1 |
18621 | 16 | CE1 | 130.1 | 1 |
18876 | 58 | CE1 | 133.077 | 1 |
18876 | 65 | CE1 | 133.150 | 1 |
18966 | 107 | CE1 | 130.583 | 3 |
19428 | 10 | CE1 | 177.717 | |
19961 | 46 | CE1 | 130.840 | 1 |
19967 | 48 | CE1 | 131.944 | 1 |
25239 | 16 | CE1 | 130.4 | 1 |
25239 | 97 | CE1 | 133.0 | 1 |
25243 | 73 | CE1 | 130.196 | |
25453 | 104 | CE1 | 132.930 | 3 |
25453 | 128 | CE1 | 133.793 | 3 |
25907 | 67 | CE1 | 132.086 | |
27284 | 111 | CE1 | 130.012 | |
27284 | 188 | CE1 | 133.425 | |
34139 | 60 | CE1 | 135.197 | |
34202 | 92 | CE1 | 130.459 | |
34216 | 13 | CE1 | 149.609 | |
34216 | 94 | CE1 | 150.360 | |
34248 | 121 | CE1 | 130.304 | 1 |
34511 | 72 | CE1 | 182.764 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4150 | 106 | CE1 | 78.599 | |
4150 | 45 | CE1 | 78.094 | |
4150 | 79 | CE1 | 78.958 | |
4150 | 93 | CE1 | 78.257 | |
4368 | 76 | CE1 | 98.80 | 3 |
4641 | 72 | CE1 | 73.1000 | |
5179 | 23 | CE1 | 70.120 | |
5179 | 77 | CE1 | 70.720 | |
5363 | 17 | CE1 | 52.100 | 2 |
5467 | 102 | CE1 | 44.44 | 1 |
6072 | 25 | CE1 | 62.300 | 1 |
6072 | 61 | CE1 | 61.900 | 1 |
6247 | 19 | CE1 | 72.036 | |
6308 | 43 | CE1 | 42.513 | |
6308 | 71 | CE1 | 43.320 | |
6308 | 76 | CE1 | 42.933 | |
6308 | 91 | CE1 | 42.860 | |
6385 | 10 | CE1 | 100.654 | 1 |
6730 | 13 | CE1 | 41.427 | |
6730 | 66 | CE1 | 42.303 | |
6730 | 74 | CE1 | 40.435 | |
6730 | 80 | CE1 | 42.303 | |
16195 | 108 | CE1 | 97.436 | 3 |
16195 | 34 | CE1 | 99.752 | 3 |
16195 | 44 | CE1 | 100.430 | 3 |
16339 | 3 | CE1 | 49.570 | 3 |
16672 | 31 | CE1 | 54.341 | 3 |
16672 | 51 | CE1 | 54.171 | 3 |
16672 | 94 | CE1 | 54.337 | 3 |
16814 | 23 | CE1 | 58.025 | 3 |
16815 | 4 | CE1 | 57.593 | 3 |
17073 | 51 | CE1 | 56.8200 | 3 |
18235 | 65 | CE1 | 42.4 | 3 |
25382 | 46 | CE1 | 62.636 | |
25382 | 52 | CE1 | 61.688 | |
26552 | 124 | CE1 | 54.6666 | |
26552 | 31 | CE1 | 54.6666 | |
26552 | 90 | CE1 | 53.8366 | |
30322 | 191 | CE1 | 50.994 | 1 |
34022 | 6 | CE1 | 54.6666 | |
34022 | 65 | CE1 | 53.8366 | |
34022 | 99 | CE1 | 54.6666 | |
34042 | 107 | CE1 | 78.195 | |
34042 | 112 | CE1 | 76.927 | |
34042 | 15 | CE1 | 77.555 | |
34042 | 25 | CE1 | 77.375 | |
34042 | 45 | CE1 | 75.755 | |
34042 | 65 | CE1 | 77.915 | |
34042 | 71 | CE1 | 77.466 | |
34042 | 85 | CE1 | 76.925 | |
34234 | 39 | CE1 | 53.840 | |
34239 | 11 | CE1 | 92.892 | |
34239 | 47 | CE1 | 92.486 |