Average chemical shift: 1.264
Standard deviation: 0.447
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
923 | 80 | HG12 | 3.08 | 2 |
1171 | 75 | HG12 | 3.04 | 2 |
1751 | 95 | HG12 | 3.5 | 2 |
4837 | 99 | HG12 | 5.56 | 2 |
5162 | 27 | HG12 | 2.67 | 2 |
5172 | 27 | HG12 | 3.21 | 2 |
5172 | 42 | HG12 | 2.65 | 2 |
5175 | 22 | HG12 | 2.66 | 1 |
5662 | 35 | HG12 | 2.66 | |
5827 | 9 | HG12 | 2.96 | 1 |
6147 | 44 | HG12 | 2.691 | 1 |
19701 | 16 | HG12 | 2.61 | |
25477 | 38 | HG12 | 4.296 | 2 |
26775 | 72 | HG12 | 2.650 | 1 |
30133 | 128 | HG12 | 3.034 | 9 |
34095 | 34 | HG12 | 2.849 | 2 |
36011 | 72 | HG12 | 2.650 | 1 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
287 | 65 | HG12 | -1.79 | 1 |
1028 | 99 | HG12 | -7.5 | 1 |
1030 | 99 | HG12 | -8.3 | 1 |
1031 | 99 | HG12 | -8.9 | 1 |
1032 | 99 | HG12 | -8.6 | 1 |
1033 | 99 | HG12 | -7.9 | 1 |
1413 | 99 | HG12 | -8.7 | 1 |
1467 | 99 | HG12 | -8.76 | 1 |
1469 | 99 | HG12 | -9.7 | 1 |
1471 | 99 | HG12 | -7.81 | 1 |
2345 | 99 | HG12 | -10 | 1 |
2346 | 99 | HG12 | -10 | 1 |
2347 | 99 | HG12 | -10.1 | 1 |
2348 | 99 | HG12 | -9.7 | 1 |
4011 | 23 | HG12 | -0.26 | 2 |
4081 | 126 | HG12 | -0.54 | 1 |
4143 | 60 | HG12 | -0.327 | 1 |
4160 | 64 | HG12 | -0.58 | 2 |
4165 | 64 | HG12 | -0.53 | 2 |
4377 | 51 | HG12 | -0.95 | 2 |
4562 | 98 | HG12 | -2.02 | 2 |
4602 | 76 | HG12 | -0.15 | 9 |
4919 | 121 | HG12 | -0.282 | 1 |
4945 | 67 | HG12 | -0.36 | 1 |
5010 | 10 | HG12 | -0.66 | 2 |
5068 | 99 | HG12 | -2.12 | 2 |
5094 | 74 | HG12 | -0.75 | |
5142 | 106 | HG12 | -0.471 | |
5172 | 43 | HG12 | -1.67 | 1 |
5177 | 124 | HG12 | -0.10 | 2 |
5189 | 15 | HG12 | -0.45 | 2 |
5275 | 175 | HG12 | -0.373 | 1 |
5279 | 39 | HG12 | -0.495 | |
5299 | 23 | HG12 | -0.800 | 2 |
5393 | 155 | HG12 | -0.804 | 2 |
5563 | 60 | HG12 | -0.244 | 1 |
5597 | 27 | HG12 | -0.95 | 1 |
5780 | 51 | HG12 | -0.31 | 1 |
5803 | 99 | HG12 | -2.04 | 2 |
5804 | 99 | HG12 | -1.39 | 2 |
5820 | 70 | HG12 | -0.423 | |
5821 | 29 | HG12 | -0.09 | 2 |
5823 | 29 | HG12 | -0.09 | 2 |
5846 | 79 | HG12 | -0.56 | 2 |
5959 | 45 | HG12 | -0.16 | 2 |
6081 | 41 | HG12 | -0.401 | 1 |
6131 | 74 | HG12 | -0.181 | 1 |
6265 | 68 | HG12 | -0.61 | 2 |
6283 | 39 | HG12 | -0.13 | 1 |
6298 | 151 | HG12 | -0.367 | |
6310 | 77 | HG12 | -0.199 | |
6333 | 72 | HG12 | -0.856 | 2 |
6341 | 70 | HG12 | -0.162 | 2 |
6415 | 99 | HG12 | -2.12 | 2 |
6457 | 61 | HG12 | -0.304 | |
6458 | 61 | HG12 | -0.37 | 1 |
6533 | 29 | HG12 | -0.662 | 2 |
6563 | 6 | HG12 | -0.094 | 1 |
6575 | 82 | HG12 | -0.382 | 1 |
6607 | 15 | HG12 | -0.92 | 2 |
6658 | 70 | HG12 | -0.556 | 2 |
6686 | 28 | HG12 | -5.4 | |
6686 | 53 | HG12 | -0.26 | |
6686 | 64 | HG12 | -1.41 | |
6688 | 176 | HG12 | -0.28 | 1 |
6692 | 75 | HG12 | -0.909 | 1 |
6726 | 140 | HG12 | -0.656 | 1 |
6919 | 47 | HG12 | -1.227 | 2 |
6944 | 141 | HG12 | -0.364 | |
6964 | 16 | HG12 | -0.08 | 2 |
7002 | 61 | HG12 | -0.16 | 2 |
7054 | 34 | HG12 | -0.51 | 2 |
7061 | 44 | HG12 | -0.2800 | |
7061 | 84 | HG12 | -1.2400 | |
7061 | 95 | HG12 | -0.2800 | |
7083 | 79 | HG12 | -0.220 | 1 |
7095 | 43 | HG12 | -0.989 | 2 |
7129 | 41 | HG12 | -0.624 | 1 |
7144 | 98 | HG12 | -2.06 | |
7150 | 85 | HG12 | -1.29 | 1 |
7160 | 98 | HG12 | -2.12 | |
7184 | 76 | HG12 | -1.230 | 2 |
7192 | 43 | HG12 | -0.39 | 2 |
7193 | 46 | HG12 | -0.388 | 2 |
7219 | 140 | HG12 | -0.130 | 1 |
7270 | 55 | HG12 | -0.22 | 1 |
7381 | 18 | HG12 | -1.128 | 1 |
7414 | 62 | HG12 | -0.627 | 1 |
10067 | 35 | HG12 | -0.379 | 2 |
10092 | 46 | HG12 | -0.529 | 2 |
10115 | 79 | HG12 | -0.513 | 2 |
10144 | 207 | HG12 | -0.313 | 2 |
10145 | 217 | HG12 | -0.299 | 2 |
10251 | 95 | HG12 | -0.161 | 2 |
10321 | 31 | HG12 | -0.334 | 2 |
11094 | 97 | HG12 | -1.468 | 2 |
11124 | 26 | HG12 | -1.278 | 2 |
11126 | 100 | HG12 | -0.632 | 2 |
11143 | 85 | HG12 | -0.374 | 2 |
11145 | 108 | HG12 | -0.419 | 2 |
11146 | 148 | HG12 | -0.537 | 2 |
11182 | 99 | HG12 | -1.342 | 2 |
11224 | 32 | HG12 | -0.117 | 2 |
11233 | 33 | HG12 | -0.080 | 2 |
11262 | 46 | HG12 | -0.302 | 2 |
11262 | 77 | HG12 | -0.566 | 2 |
11268 | 88 | HG12 | -0.632 | 2 |
11305 | 25 | HG12 | -0.563 | 2 |
11422 | 15 | HG12 | -0.811 | 2 |
11428 | 25 | HG12 | -0.28 | 2 |
11490 | 76 | HG12 | -0.176 | 1 |
11495 | 76 | HG12 | -0.309 | 1 |
11504 | 12 | HG12 | -0.173 | 2 |
11505 | 61 | HG12 | -0.238 | 2 |
11547 | 61 | HG12 | -0.482 | 2 |
15009 | 6 | HG12 | -0.523 | 1 |
15023 | 71 | HG12 | -0.37 | 1 |
15028 | 127 | HG12 | -0.796 | 1 |
15028 | 6 | HG12 | -0.160 | 1 |
15090 | 30 | HG12 | -0.595 | 2 |
15230 | 112 | HG12 | -0.923 | 2 |
15258 | 15 | HG12 | -0.30 | 2 |
15280 | 128 | HG12 | -0.221 | 1 |
15401 | 18 | HG12 | -1.128 | 1 |
15402 | 18 | HG12 | -1.151 | 1 |
15633 | 60 | HG12 | -0.417 | 2 |
15635 | 60 | HG12 | -0.380 | 2 |
15636 | 60 | HG12 | -0.371 | 2 |
15637 | 60 | HG12 | -0.395 | 2 |
15642 | 30 | HG12 | -0.49 | 2 |
15727 | 127 | HG12 | -0.257 | 2 |
15833 | 57 | HG12 | -0.52 | 2 |
15877 | 24 | HG12 | -0.561 | 2 |
15877 | 35 | HG12 | -0.177 | 2 |
15913 | 45 | HG12 | -0.7500 | 2 |
15914 | 66 | HG12 | -0.305 | 2 |
15916 | 63 | HG12 | -0.69 | 2 |
15922 | 77 | HG12 | -0.311 | |
15943 | 46 | HG12 | -0.86 | 2 |
15981 | 20 | HG12 | -0.103 | 2 |
16009 | 86 | HG12 | -0.299 | 2 |
16063 | 23 | HG12 | -0.2400 | |
16063 | 4 | HG12 | -1.1760 | |
16228 | 61 | HG12 | -0.417 | 1 |
16273 | 12 | HG12 | -0.082 | |
16273 | 77 | HG12 | -0.493 | |
16306 | 86 | HG12 | -0.42 | 1 |
16339 | 41 | HG12 | -0.100 | 1 |
16384 | 77 | HG12 | -0.21 | 2 |
16779 | 18 | HG12 | -0.476 | |
16822 | 51 | HG12 | -0.892 | 2 |
16831 | 18 | HG12 | -0.678 | 1 |
16835 | 32 | HG12 | -0.105 | 2 |
16842 | 38 | HG12 | -0.203 | 1 |
16880 | 61 | HG12 | -0.609 | 2 |
16885 | 61 | HG12 | -0.643 | 2 |
17137 | 35 | HG12 | -0.589 | 1 |
17280 | 111 | HG12 | -0.714 | 2 |
17318 | 66 | HG12 | -0.134 | 2 |
17390 | 92 | HG12 | -1.446 | 2 |
17418 | 77 | HG12 | -0.088 | |
17525 | 75 | HG12 | -0.446 | 2 |
17582 | 8 | HG12 | -0.468 | 2 |
17610 | 52 | HG12 | -0.367 | 2 |
17670 | 154 | HG12 | -0.690 | 1 |
17686 | 7 | HG12 | -0.45 | 1 |
17723 | 49 | HG12 | -1.212 | 2 |
17738 | 105 | HG12 | -0.104 | 2 |
17747 | 107 | HG12 | -0.128 | 2 |
17824 | 76 | HG12 | -0.368 | 2 |
17879 | 33 | HG12 | -0.106 | 2 |
17952 | 35 | HG12 | -0.531 | 2 |
18011 | 179 | HG12 | -0.086 | 2 |
18039 | 121 | HG12 | -0.361 | 1 |
18135 | 126 | HG12 | -0.586 | 2 |
18298 | 159 | HG12 | -0.19 | 2 |
18342 | 46 | HG12 | -0.256 | 9 |
18390 | 27 | HG12 | -0.844 | 2 |
18400 | 30 | HG12 | -0.637 | 2 |
18431 | 29 | HG12 | -0.350 | |
18432 | 24 | HG12 | -0.396 | |
18433 | 44 | HG12 | -0.374 | |
18445 | 30 | HG12 | -0.555 | 2 |
18447 | 30 | HG12 | -0.533 | 2 |
18728 | 163 | HG12 | -0.598 | 2 |
18765 | 80 | HG12 | -0.579 | 2 |
18787 | 38 | HG12 | -0.216 | 1 |
18801 | 6 | HG12 | -0.166 | |
18831 | 63 | HG12 | -0.346 | 2 |
18845 | 76 | HG12 | -0.340 | 2 |
18846 | 76 | HG12 | -0.469 | 2 |
18919 | 80 | HG12 | -0.526 | |
18953 | 4 | HG12 | -0.6210 | 2 |
18989 | 27 | HG12 | -0.12 | 2 |
19026 | 5 | HG12 | -0.111 | 2 |
19303 | 14 | HG12 | -0.522 | |
19367 | 77 | HG12 | -1.130 | 2 |
19479 | 73 | HG12 | -0.130 | |
19516 | 31 | HG12 | -0.089 | 1 |
19625 | 112 | HG12 | -0.2 | 2 |
19653 | 76 | HG12 | -0.484 | 2 |
19694 | 47 | HG12 | -0.5200 | |
19757 | 67 | HG12 | -000.148 | 1 |
19801 | 34 | HG12 | -0.3210 | 2 |
19851 | 39 | HG12 | -0.223 | 2 |
19945 | 36 | HG12 | -1.341 | |
19984 | 4 | HG12 | -0.45 | 2 |
19985 | 40 | HG12 | -0.648 | 1 |
25070 | 64 | HG12 | -0.502 | 2 |
25085 | 42 | HG12 | -0.604 | 1 |
25127 | 164 | HG12 | -0.168 | 2 |
25230 | 63 | HG12 | -0.240 | 2 |
25404 | 18 | HG12 | -0.8540 | 2 |
25432 | 223 | HG12 | -0.247 | 1 |
25446 | 36 | HG12 | -0.275 | |
25459 | 59 | HG12 | -0.21 | 2 |
25492 | 81 | HG12 | -0.165 | 2 |
25545 | 61 | HG12 | -0.399 | 2 |
25545 | 61 | HG12 | -0.555 | 2 |
25559 | 19 | HG12 | -0.491 | 2 |
25582 | 12 | HG12 | -0.158 | 1 |
25599 | 77 | HG12 | -0.51 | 2 |
25789 | 44 | HG12 | -0.595 | 2 |
25874 | 38 | HG12 | -0.154 | 2 |
25885 | 79 | HG12 | -0.409 | 2 |
25919 | 34 | HG12 | -0.197 | 2 |
25993 | 3 | HG12 | -0.431 | 2 |
26048 | 9 | HG12 | -0.141 | 1 |
26053 | 73 | HG12 | -0.860 | 2 |
26854 | 139 | HG12 | -0.418 | 1 |
26854 | 70 | HG12 | -0.177 | 1 |
26854 | 81 | HG12 | -1.027 | 1 |
26991 | 63 | HG12 | -0.228 | 2 |
27363 | 38 | HG12 | -0.363 | 2 |
27481 | 100 | HG12 | -0.209 | 2 |
27481 | 70 | HG12 | -0.296 | 2 |
27574 | 33 | HG12 | -0.400 | 2 |
27688 | 10 | HG12 | -0.093 | 2 |
27781 | 102 | HG12 | -0.673 | 2 |
27869 | 9 | HG12 | -0.673 | 2 |
28042 | 61 | HG12 | -0.443 | |
28042 | 78 | HG12 | -0.352 | |
28046 | 111 | HG12 | -0.705 | 2 |
30061 | 42 | HG12 | -0.223 | 2 |
30093 | 59 | HG12 | -0.0853 | |
30139 | 24 | HG12 | -0.28 | 1 |
30186 | 101 | HG12 | -1.576 | 2 |
30295 | 73 | HG12 | -0.395 | 2 |
30345 | 8 | HG12 | -0.125 | |
30590 | 62 | HG12 | -0.221 | 2 |
30693 | 61 | HG12 | -0.321 | 1 |
30825 | 100 | HG12 | -0.085 | 2 |
30825 | 46 | HG12 | -0.435 | 2 |
30962 | 36 | HG12 | -0.106 | |
34077 | 42 | HG12 | -0.418 | 1 |
34223 | 67 | HG12 | -0.151 | 1 |
34224 | 67 | HG12 | -00.152 | 1 |
34307 | 32 | HG12 | -0.215 | 2 |
34462 | 14 | HG12 | -0.451 | 1 |
34462 | 50 | HG12 | -0.469 | 1 |
34551 | 28 | HG12 | -0.135 | 2 |
34693 | 13 | HG12 | -0.390 | 2 |
34695 | 87 | HG12 | -0.122 | |
34717 | 176 | HG12 | -0.666 | 2 |
34724 | 35 | HG12 | -0.275 | |
34727 | 35 | HG12 | -0.139 | 1 |
34813 | 28 | HG12 | -0.124 | 2 |
36060 | 5 | HG12 | -0.239 | |
36086 | 112 | HG12 | -0.159 | |
36163 | 94 | HG12 | -0.2820 | 1 |
36527 | 68 | HG12 | -0.581 | |
36528 | 68 | HG12 | -0.568 | |
50269 | 115 | HG12 | -0.08 | 2 |
50269 | 95 | HG12 | -0.61 | 2 |
50330 | 61 | HG12 | -0.439 | 2 |
50428 | 19 | HG12 | -0.572 | 2 |
50517 | 7 | HG12 | -0.406 | 2 |
51342 | 100 | HG12 | -0.370 | 2 |
51470 | 81 | HG12 | -0.306 | 1 |
51471 | 81 | HG12 | -0.378 | 2 |
51495 | 9 | HG12 | -0.111 | 2 |
52147 | 45 | HG12 | -0.199 |