Average chemical shift: 8.256
Standard deviation: 0.732
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
274 | 18 | H | 11 | 1 |
292 | 93 | H | 13.2 | 1 |
346 | 23 | H | 11.02 | 1 |
923 | 23 | H | 11.02 | 1 |
1171 | 18 | H | 10.78 | 1 |
1207 | 61 | H | 11.13 | 1 |
1719 | 23 | H | 11.02 | 1 |
1808 | 170 | H | 11.98 | 1 |
1839 | 175 | H | 12.9 | 1 |
1841 | 175 | H | 12.8 | 1 |
1889 | 175 | H | 12.8 | 1 |
2038 | 177 | H | 11.57 | 1 |
2208 | 92 | H | 10.58 | 1 |
4022 | 107 | H | 10.8 | 1 |
4049 | 82 | H | 10.47 | 1 |
4435 | 26 | H | 11.67 | 1 |
4435 | 38 | H | 10.57 | 1 |
4435 | 39 | H | 11.22 | 1 |
4435 | 55 | H | 12.44 | 1 |
4602 | 63 | H | 11.45 | 1 |
4744 | 17 | H | 11.517 | |
4744 | 20 | H | 12.046 | |
4744 | 30 | H | 11.649 | |
4744 | 45 | H | 11.412 | |
4777 | 18 | H | 11.74 | 1 |
4777 | 29 | H | 10.52 | 1 |
4805 | 61 | H | 11.44 | 1 |
4806 | 61 | H | 11.28 | 1 |
4807 | 61 | H | 11.40 | 1 |
4810 | 61 | H | 11.44 | 1 |
4837 | 53 | H | 12.81 | 1 |
4837 | 95 | H | 12.26 | 1 |
4955 | 5 | H | 10.615 | 1 |
5005 | 27 | H | 11.44 | 1 |
5019 | 98 | H | 11.030 | 1 |
5026 | 18 | H | 10.93 | |
5172 | 15 | H | 13.01 | 1 |
5239 | 25 | H | 11.48 | 1 |
5239 | 67 | H | 10.47 | 1 |
5269 | 46 | H | 10.71 | 1 |
5279 | 17 | H | 11.596 | |
5279 | 20 | H | 12.167 | |
5279 | 30 | H | 11.722 | |
5279 | 45 | H | 11.522 | |
5352 | 60 | H | 10.63 | |
5396 | 64 | H | 10.536 | 1 |
5466 | 10 | H | 11.4 | |
5625 | 22 | H | 11.89 | 1 |
5625 | 34 | H | 10.63 | 1 |
5625 | 35 | H | 11.72 | 1 |
5625 | 52 | H | 12.61 | 1 |
5625 | 67 | H | 10.69 | 1 |
5712 | 37 | H | 10.73 | 1 |
5721 | 188 | H | 10.46 | 1 |
5745 | 67 | H | 11.36 | 1 |
5802 | 69 | H | 10.68 | 1 |
5809 | 87 | H | 13.08 | 1 |
5809 | 87 | H | 13.18 | 1 |
5828 | 18 | H | 10.94 | 1 |
5830 | 18 | H | 10.88 | 1 |
6131 | 61 | H | 11.652 | 1 |
6141 | 92 | H | 10.873 | 1 |
6230 | 92 | H | 13.24 | 1 |
6230 | 92 | H | 13.34 | 1 |
6344 | 134 | H | 10.96 | 1 |
6365 | 51 | H | 10.98 | 1 |
6369 | 48 | H | 10.72 | 1 |
6572 | 22 | H | 11.86 | 1 |
6572 | 34 | H | 10.58 | 1 |
6572 | 52 | H | 12.22 | 1 |
6572 | 67 | H | 11.03 | 1 |
6572 | 83 | H | 11.97 | 1 |
6634 | 22 | H | 11.86 | 1 |
6634 | 34 | H | 10.50 | 1 |
6634 | 35 | H | 11.59 | 1 |
6634 | 52 | H | 12.61 | 1 |
6634 | 67 | H | 10.68 | 1 |
6823 | 160 | H | 10.467 | 1 |
6843 | 8 | H | 10.75 | 1 |
6921 | 67 | H | 10.967 | 1 |
6940 | 34 | H | 10.525 | 1 |
6983 | 146 | H | 11.22 | 1 |
6987 | 146 | H | 11.25 | 1 |
7000 | 25 | H | 11.11 | 1 |
7115 | 37 | H | 10.70 | 1 |
7194 | 16 | H | 10.495 | 1 |
7310 | 92 | H | 10.878 | 1 |
7359 | 57 | H | 11.389 | 1 |
7360 | 57 | H | 11.389 | 1 |
10029 | 74 | H | 12.392 | 1 |
10134 | 14 | H | 10.476 | 1 |
11175 | 89 | H | 11.428 | 1 |
11424 | 78 | H | 10.591 | 1 |
11575 | 83 | H | 10.697 | 1 |
12014 | 102 | H | 10.6768 | 1 |
15301 | 23 | H | 11.219 | 1 |
15680 | 18 | H | 10.487 | 1 |
16146 | 4 | H | 10.641 | 1 |
16306 | 45 | H | 11.04 | 1 |
16307 | 45 | H | 10.64 | 1 |
16307 | 45 | H | 10.67 | 1 |
16307 | 69 | H | 10.46 | 1 |
16443 | 22 | H | 11.707 | 1 |
16443 | 25 | H | 11.027 | 1 |
16443 | 34 | H | 10.999 | 1 |
16443 | 35 | H | 12.377 | 1 |
16443 | 52 | H | 12.348 | 1 |
16443 | 69 | H | 11.004 | 1 |
16464 | 150 | H | 10.460 | 1 |
16805 | 28 | H | 10.680 | 1 |
16940 | 79 | H | 10.46 | 1 |
16969 | 26 | H | 11.989 | 1 |
17009 | 52 | H | 11.815 | 1 |
17144 | 18 | H | 11.23 | 1 |
17226 | 81 | H | 10.614 | 1 |
17236 | 18 | H | 11.07 | 1 |
17311 | 64 | H | 10.585 | 1 |
17362 | 88 | H | 10.56 | 1 |
17586 | 92 | H | 10.774 | 1 |
17660 | 216 | H | 10.800 | 1 |
17824 | 74 | H | 10.457 | 1 |
17845 | 23 | H | 10.99 | 1 |
17845 | 23 | H | 11.00 | 1 |
17847 | 18 | H | 10.77 | 1 |
17847 | 18 | H | 10.78 | 1 |
17886 | 28 | H | 10.723 | 1 |
17903 | 23 | H | 10.592 | |
17903 | 76 | H | 11.262 | |
18032 | 28 | H | 10.68 | 1 |
18263 | 28 | H | 10.68 | 1 |
18312 | 95 | H | 10.74 | 1 |
18345 | 8 | H | 10.50 | 1 |
18477 | 164 | H | 10.59 | 1 |
18588 | 45 | H | 10.85 | 1 |
18628 | 82 | H | 10.893 | 1 |
18741 | 190 | H | 11.344 | 1 |
18782 | 35 | H | 10.847 | 1 |
18919 | 68 | H | 11.404 | |
19079 | 8 | H | 10.809 | |
19432 | 104 | H | 10.6589 | 1 |
19638 | 23 | H | 11.098 | |
19643 | 31 | H | 10.469 | 1 |
19818 | 64 | H | 10.582 | 1 |
19818 | 64 | H | 10.610 | 1 |
19818 | 96 | H | 11.230 | 1 |
19818 | 96 | H | 11.614 | 1 |
19819 | 96 | H | 10.859 | 1 |
19819 | 96 | H | 11.304 | 1 |
25104 | 92 | H | 10.736 | |
25150 | 83 | H | 10.996 | |
25336 | 84 | H | 10.945 | 1 |
25337 | 92 | H | 10.728 | 1 |
25340 | 93 | H | 10.963 | 1 |
25418 | 18 | H | 10.809 | 1 |
25422 | 18 | H | 10.954 | 1 |
25477 | 17 | H | 11.607 | 1 |
25477 | 20 | H | 12.109 | 1 |
25477 | 31 | H | 11.948 | 1 |
25477 | 47 | H | 11.691 | 1 |
25477 | 69 | H | 11.614 | 1 |
25502 | 92 | H | 10.706 | |
25832 | 110 | H | 10.969 | 1 |
25834 | 43 | H | 11.289 | 1 |
25887 | 15 | H | 11.587 | 1 |
25908 | 18 | H | 10.831 | |
26578 | 18 | H | 10.728 | 1 |
26700 | 26 | H | 11.904 | 1 |
26788 | 209 | H | 10.735 | 1 |
26851 | 154 | H | 10.532 | 1 |
26885 | 76 | H | 11.37 | |
26962 | 206 | H | 11.593 | |
27022 | 170 | H | 10.658 | 1 |
27082 | 161 | H | 11.490 | |
27159 | 102 | H | 10.689 | 1 |
27254 | 18 | H | 10.818 | 1 |
27265 | 92 | H | 10.720 | 1 |
27427 | 37 | H | 10.687 | 1 |
27428 | 37 | H | 10.687 | 1 |
27620 | 94 | H | 10.73 | 1 |
27859 | 107 | H | 10.56 | |
27987 | 17 | H | 11.602 | 1 |
27987 | 20 | H | 11.836 | 1 |
27987 | 31 | H | 12.014 | 1 |
27987 | 47 | H | 12.624 | 1 |
27987 | 68 | H | 11.714 | 1 |
30475 | 8 | H | 10.692 | 1 |
30770 | 133 | H | 11.785 | |
30977 | 92 | H | 10.710 | 1 |
34308 | 107 | H | 10.778 | 1 |
34347 | 107 | H | 10.789 | |
34361 | 43 | H | 12.022 | 1 |
34817 | 121 | H | 10.801 | 1 |
36075 | 25 | H | 10.58 | 1 |
50476 | 194 | H | 10.627 | 1 |
50576 | 194 | H | 10.6421 | |
51210 | 28 | H | 10.6600 | 1 |
51502 | 7 | H | 11.126 | 1 |
51503 | 7 | H | 11.260 | 1 |
51848 | 45 | H | 10.76 | 1 |
51848 | 69 | H | 10.56 | 1 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
294 | 37 | H | 6.01 | 1 |
295 | 37 | H | 6.04 | 1 |
1208 | 37 | H | 6.05 | 1 |
4049 | 80 | H | 5.82 | 1 |
4102 | 145 | H | 5.79 | 1 |
4102 | 84 | H | 5.53 | 1 |
4127 | 20 | H | 4.60 | 1 |
4130 | 39 | H | 6.01 | |
4130 | 63 | H | 6.02 | |
4131 | 39 | H | 5.91 | |
4131 | 63 | H | 5.96 | |
4173 | 129 | H | 5.30 | 1 |
4291 | 106 | H | 5.975 | 1 |
4291 | 25 | H | 5.896 | 1 |
4291 | 35 | H | 4.477 | 1 |
4291 | 70 | H | 5.850 | 1 |
4342 | 89 | H | 5.94 | 1 |
4364 | 122 | H | 5.23 | 1 |
4436 | 29 | H | 5.81 | 1 |
4436 | 73 | H | 5.84 | 1 |
4444 | 119 | H | 5.93 | |
4743 | 53 | H | 5.75 | 1 |
4803 | 37 | H | 6.00 | 1 |
5019 | 46 | H | 6.056 | 1 |
5147 | 54 | H | 6.02 | 1 |
5333 | 106 | H | 5.80 | 1 |
5333 | 25 | H | 5.89 | 1 |
5333 | 35 | H | 4.45 | 1 |
5864 | 3 | H | -0.3 | |
6012 | 64 | H | 5.940 | 1 |
6238 | 42 | H | 6.028 | 1 |
6249 | 180 | H | 5.410 | 1 |
6966 | 17 | H | 5.83 | 1 |
6973 | 57 | H | 6.01 | |
6974 | 57 | H | 6.002 | |
7016 | 32 | H | 0.02 | |
7319 | 51 | H | 6.01 | 1 |
10042 | 76 | H | 6.032 | 1 |
11315 | 64 | H | 5.818 | 1 |
15120 | 124 | H | 5.29 | |
15233 | 90 | H | 5.958 | 1 |
15235 | 90 | H | 5.949 | 1 |
15395 | 124 | H | 5.241 | |
15396 | 124 | H | 5.24 | |
15685 | 6 | H | 1.000 | 1 |
15736 | 154 | H | 5.883 | 1 |
16390 | 86 | H | 6.02 | 1 |
16674 | 35 | H | 4.226 | 1 |
16842 | 55 | H | 5.405 | 1 |
17747 | 129 | H | 5.122 | 1 |
17816 | 19 | H | 3.970 | 1 |
17947 | 69 | H | 5.69 | 1 |
18267 | 51 | H | 6.032 | 1 |
18422 | 69 | H | 5.48 | 1 |
18601 | 153 | H | 1.596 | 1 |
18749 | 51 | H | 5.89 | 1 |
18787 | 55 | H | 5.393 | 1 |
18990 | 49 | H | 5.2910 | 1 |
19147 | 53 | H | 5.918 | 1 |
19985 | 21 | H | 5.868 | 1 |
19985 | 56 | H | 5.942 | 1 |
25761 | 102 | H | 5.928 | |
25874 | 55 | H | 5.404 | 1 |
26059 | 59 | H | 5.1600 | 1 |
26060 | 59 | H | 5.1600 | 1 |
26886 | 76 | H | 5.44 | |
27080 | 20 | H | 5.929 | 1 |
30375 | 242 | H | 5.783 | |
30528 | 68 | H | 6.048 | |
34584 | 66 | H | 5.917 | 1 |
50000 | 123 | H | 5.9997 | 1 |
50356 | 66 | H | 5.917 | 1 |
50357 | 272 | H | 5.920 | 1 |
50732 | 54 | H | 6.022 | 1 |
51785 | 229 | H | 3.139 | 1 |
51785 | 229 | H | 3.177 | 1 |