Average chemical shift: 8.194
Standard deviation: 0.753
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
349 | 66 | H | 10.86 | 1 |
2224 | 67 | H | 11.35 | 1 |
4106 | 100 | H | 10.5211 | |
4236 | 172 | H | 10.97 | 1 |
4236 | 191 | H | 10.80 | 1 |
4264 | 100 | H | 10.46 | 1 |
4265 | 23 | H | 11.58 | 1 |
4329 | 156 | H | 10.96 | 1 |
4329 | 175 | H | 10.81 | 1 |
4331 | 45 | H | 11.05 | 1 |
4341 | 141 | H | 11.542 | 1 |
4354 | 168 | H | 10.481 | 1 |
4384 | 114 | H | 11.136 | 1 |
4438 | 9 | H | 10.70 | 1 |
4744 | 19 | H | 10.866 | |
4744 | 21 | H | 10.619 | |
4744 | 35 | H | 11.433 | |
4770 | 16 | H | 10.48 | 1 |
4955 | 12 | H | 10.620 | 1 |
4985 | 23 | H | 11.59 | 1 |
4986 | 168 | H | 10.750 | 1 |
5239 | 4 | H | 12.25 | 1 |
5279 | 19 | H | 10.972 | |
5279 | 21 | H | 10.742 | |
5279 | 35 | H | 11.585 | |
5368 | 26 | H | 10.78 | 1 |
5396 | 6 | H | 10.749 | 1 |
5499 | 42 | H | 10.8100 | |
5511 | 13 | H | 10.57 | 1 |
5514 | 37 | H | 10.79 | 1 |
5666 | 37 | H | 10.714 | 1 |
5706 | 127 | H | 10.570 | 1 |
5809 | 88 | H | 10.96 | 1 |
5809 | 88 | H | 11.02 | 1 |
5819 | 55 | H | 10.52 | 1 |
5843 | 85 | H | 11.58 | 1 |
5918 | 67 | H | 11.250 | 1 |
6047 | 166 | H | 10.840 | 1 |
6051 | 97 | H | 10.547 | 1 |
6055 | 166 | H | 10.86 | 1 |
6304 | 75 | H | 10.936 | 1 |
6429 | 105 | H | 10.88 | 1 |
6514 | 144 | H | 10.94 | 1 |
6685 | 213 | H | 11.857 | 1 |
6807 | 168 | H | 10.587 | 1 |
6935 | 215 | H | 10.54 | 1 |
6965 | 55 | H | 10.49 | 1 |
6966 | 36 | H | 10.57 | 1 |
6983 | 126 | H | 14.8 | 1 |
6987 | 126 | H | 13.2 | 1 |
7004 | 64 | H | 10.55 | 1 |
7114 | 168 | H | 10.65 | 1 |
7130 | 95 | H | 10.910 | 1 |
7277 | 67 | H | 11.479 | 1 |
7286 | 144 | H | 10.976 | 1 |
7300 | 2 | H | 10.74 | 1 |
7300 | 3 | H | 10.73 | 1 |
10132 | 17 | H | 10.504 | 1 |
11434 | 171 | H | 10.575 | 1 |
11436 | 171 | H | 10.627 | 1 |
11522 | 174 | H | 10.545 | 1 |
12032 | 46 | H | 10.496 | |
15219 | 109 | H | 11.20 | 1 |
15248 | 167 | H | 11.224 | 1 |
15250 | 167 | H | 11.194 | 1 |
15327 | 76 | H | 10.95 | 1 |
15424 | 13 | H | 10.666 | 1 |
15440 | 85 | H | 10.679 | 1 |
15514 | 212 | H | 10.465 | 1 |
15671 | 1 | H | 10.497 | 1 |
15706 | 176 | H | 10.692 | 1 |
15826 | 46 | H | 10.709 | 1 |
16115 | 141 | H | 69.229 | 1 |
16376 | 49 | H | 10.647 | 1 |
16443 | 23 | H | 10.849 | 1 |
16475 | 165 | H | 10.74 | 1 |
16611 | 72 | H | 11.082 | 1 |
16780 | 85 | H | 10.70730 | 1 |
16881 | 12 | H | 10.70 | 1 |
16969 | 27 | H | 11.106 | 1 |
17039 | 89 | H | 10.68 | 1 |
17311 | 6 | H | 10.551 | 1 |
17388 | 58 | H | 10.592 | |
17399 | 47 | H | 10.670 | 1 |
17536 | 72 | H | 10.898 | 1 |
17890 | 130 | H | 10.629 | 1 |
18235 | 17 | H | 11.43 | 1 |
18292 | 86 | H | 10.712 | 1 |
18517 | 176 | H | 12.110 | 1 |
18588 | 226 | H | 10.74 | 1 |
18791 | 81 | H | 10.5733 | 1 |
18798 | 110 | H | 10.667 | 1 |
18798 | 165 | H | 11.585 | 1 |
18799 | 110 | H | 10.686 | 1 |
18799 | 165 | H | 11.672 | 1 |
18800 | 110 | H | 10.589 | 1 |
18800 | 165 | H | 11.367 | 1 |
18887 | 12 | H | 10.63 | |
18922 | 33 | H | 10.553 | |
18939 | 20 | H | 11.163 | 1 |
19051 | 264 | H | 11.312 | 1 |
19069 | 40 | H | 10.70 | 1 |
19182 | 77 | H | 11.405 | 1 |
19213 | 127 | H | 11.446 | 1 |
19213 | 57 | H | 11.964 | 1 |
19214 | 127 | H | 11.550 | 1 |
19421 | 128 | H | 10.961 | 1 |
19422 | 128 | H | 10.901 | 1 |
19450 | 32 | H | 11.370 | 1 |
19825 | 246 | H | 10.653 | 1 |
19852 | 151 | H | 10.640 | 1 |
19852 | 2 | H | 10.644 | 1 |
19854 | 151 | H | 10.640 | 1 |
19854 | 2 | H | 10.644 | 1 |
19971 | 79 | H | 11.654 | 1 |
25224 | 207 | H | 10.589 | 1 |
25230 | 48 | H | 10.533 | 1 |
25477 | 19 | H | 10.987 | 1 |
25553 | 72 | H | 11.082 | 1 |
25554 | 151 | H | 10.640 | 1 |
25554 | 2 | H | 10.644 | 1 |
25576 | 86 | H | 10.910 | 1 |
25705 | 90 | H | 11.07 | 1 |
25711 | 261 | H | 10.783 | 1 |
25713 | 261 | H | 10.771 | 1 |
25714 | 261 | H | 10.777 | 1 |
25715 | 261 | H | 10.770 | 1 |
25731 | 100 | H | 10.542 | |
25766 | 111 | H | 11.404 | 1 |
25828 | 3 | H | 11.630 | 1 |
25833 | 3 | H | 11.720 | 1 |
26026 | 40 | H | 11.522 | |
26532 | 33 | H | 10.5060 | 1 |
26535 | 33 | H | 10.5060 | 1 |
26700 | 27 | H | 11.049 | 1 |
26756 | 19 | H | 11.309 | |
26757 | 19 | H | 11.178 | |
26815 | 148 | H | 11.139 | 1 |
26943 | 46 | H | 24.890 | |
27082 | 166 | H | 10.532 | |
27083 | 166 | H | 10.471 | |
27160 | 158 | H | 10.499 | 1 |
27174 | 115 | H | 10.949 | 1 |
27175 | 115 | H | 11.057 | 1 |
27183 | 221 | H | 11.698 | |
27287 | 67 | H | 11.4644 | 1 |
27403 | 158 | H | 10.522 | 1 |
27445 | 199 | H | 10.719 | 1 |
27539 | 47 | H | 10.457 | 1 |
27541 | 47 | H | 10.481 | 1 |
27573 | 84 | H | 10.5008 | 1 |
27577 | 21 | H | 10.609 | 1 |
27631 | 246 | H | 10.539 | |
27632 | 246 | H | 10.549 | |
27762 | 480 | H | 11.695 | 1 |
27776 | 185 | H | 10.72 | 1 |
27948 | 94 | H | 13.9288 | |
27949 | 130 | H | 10.519 | 1 |
30326 | 100 | H | 10.627 | 1 |
30770 | 138 | H | 10.554 | |
30774 | 115 | H | 23.1280 | 1 |
30854 | 8 | H | 10.880 | 1 |
30943 | 292 | H | 12.183 | 1 |
34294 | 21 | H | 11.825 | |
34395 | 38 | H | 10.519 | 1 |
34477 | 37 | H | 10.629 | |
36000 | 86 | H | 10.910 | 1 |
36008 | 86 | H | 10.916 | 1 |
50010 | 44 | H | 10.733 | 1 |
50011 | 44 | H | 10.655 | 1 |
50030 | 169 | H | 10.590 | 1 |
50031 | 169 | H | 10.591 | 1 |
50032 | 187 | H | 10.520 | 1 |
50033 | 187 | H | 10.606 | 1 |
50139 | 103 | H | 10.787 | 1 |
50143 | 79 | H | 10.708 | 1 |
50386 | 100 | H | 10.574 | 1 |
50386 | 100 | H | 10.576 | 1 |
50393 | 25 | H | 11.122 | 1 |
50395 | 41 | H | 131.25 | 1 |
50445 | 89 | H | 10.496 | 1 |
50604 | 130 | H | 126.4375 | 1 |
50744 | 91 | H | 10.613 | 1 |
50920 | 216 | H | 10.80 | 1 |
50949 | 84 | H | 11.020 | |
50971 | 25 | H | 10.994 | 1 |
51038 | 112 | H | 11.083 | 1 |
51059 | 207 | H | 10.552 | 1 |
51105 | 292 | H | 12.2791 | 1 |
51160 | 63 | H | 11.159 | |
51162 | 63 | H | 11.160 | |
51166 | 269 | H | 11.690 | 1 |
51233 | 17 | H | 10.83442 | |
51404 | 53 | H | 10.502 | |
51681 | 15 | H | 10.630 | |
51690 | 316 | H | 11.132 | 1 |
51781 | 247 | H | 10.521 | 1 |
51790 | 18 | H | 10.925 | 1 |
51815 | 247 | H | 10.6462 | 1 |
51983 | 106 | H | 11.520 | 1 |
52296 | 305 | H | 10.489 | 1 |
52298 | 305 | H | 10.485 | 1 |
52301 | 305 | H | 10.484 | 1 |
52305 | 305 | H | 10.473 | 1 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
1162 | 22 | H | 4.1 | 1 |
1580 | 142 | H | 5.29 | 1 |
1673 | 142 | H | 5.24 | 1 |
3322 | 5 | H | 5.80 | 1 |
4101 | 32 | H | 3.97 | 1 |
4291 | 13 | H | 0.945 | 1 |
4313 | 60 | H | 5.79 | 1 |
4836 | 186 | H | 5.79 | 1 |
4881 | 150 | H | 5.26 | 1 |
4886 | 150 | H | 5.24 | 1 |
5011 | 142 | H | 5.20 | 1 |
5012 | 50 | H | 4.04 | 1 |
5171 | 37 | H | 4.36 | |
5298 | 80 | H | 5.89 | 1 |
5483 | 74 | H | 5.464 | 1 |
5497 | 59 | H | 4.884 | 1 |
5596 | 44 | H | 5.617 | 1 |
5628 | 108 | H | 3.80 | 1 |
6231 | 94 | H | 3.53 | 1 |
6249 | 119 | H | 5.370 | 1 |
6249 | 133 | H | 5.720 | 1 |
6249 | 205 | H | 5.930 | 1 |
6249 | 206 | H | 4.300 | 1 |
6249 | 228 | H | 4.680 | 1 |
6249 | 257 | H | 5.530 | 1 |
6628 | 247 | H | 5.857 | 1 |
6640 | 22 | H | 5.93 | 1 |
6783 | 80 | H | 5.72 | 1 |
7016 | 13 | H | 0.02 | |
7016 | 27 | H | 0.02 | |
7016 | 28 | H | 0.02 | |
7016 | 53 | H | 0.02 | |
7016 | 72 | H | 0.02 | |
7264 | 18 | H | 5.772 | 1 |
7264 | 92 | H | 5.874 | 1 |
7285 | 5 | H | 5.80 | 1 |
7286 | 65 | H | 5.830 | 1 |
11285 | 45 | H | 5.143 | 1 |
11442 | 80 | H | 5.888 | 1 |
15337 | 8 | H | 5.870 | 1 |
15491 | 61 | H | 5.533 | 1 |
15680 | 192 | H | 5.452 | 1 |
15816 | 51 | H | 5.77 | 1 |
15997 | 1 | H | 5.841 | 1 |
16059 | 112 | H | 5.753 | 1 |
16107 | 138 | H | 5.628 | 1 |
16133 | 121 | H | 5.668 | 1 |
16476 | 26 | H | 5.579 | 1 |
16578 | 82 | H | 5.295 | 1 |
16675 | 44 | H | 5.633 | 1 |
16807 | 82 | H | 5.269 | 1 |
16992 | 88 | H | 5.676 | 1 |
17382 | 73 | H | 5.682 | 1 |
17660 | 30 | H | 5.571 | 1 |
17829 | 149 | H | 5.928 | 1 |
17918 | 69 | H | 5.645 | 1 |
18132 | 72 | H | 0.004 | 1 |
18204 | 73 | H | 5.629 | 1 |
18303 | 79 | H | 5.872 | 1 |
18667 | 199 | H | -0.914 | 1 |
19835 | 234 | H | 5.655 | 1 |
19836 | 234 | H | 5.663 | 1 |
19837 | 234 | H | 5.566 | 1 |
19855 | 28 | H | 5.673 | 1 |
19855 | 6 | H | 5.223 | 1 |
19945 | 143 | H | 5.414 | |
25153 | 143 | H | 5.186 | |
25271 | 76 | H | 5.488 | 1 |
26835 | 183 | H | 5.328 | 1 |
26848 | 51 | H | 5.695 | 1 |
26851 | 51 | H | 5.665 | 1 |
26989 | 162 | H | 5.764 | |
27014 | 54 | H | 5.147 | 1 |
27090 | 165 | H | 3.972 | 1 |
27121 | 193 | H | 5.422 | |
27122 | 193 | H | 5.444 | |
27191 | 105 | H | 5.9259 | 1 |
27202 | 127 | H | 2.409 | |
27224 | 58 | H | 5.85 | 1 |
27239 | 223 | H | 5.47 | 1 |
27239 | 223 | H | 5.49 | 1 |
27242 | 223 | H | 5.49 | 1 |
27589 | 223 | H | 5.302 | 1 |
27590 | 223 | H | 5.426 | 1 |
27612 | 23 | H | 5.714 | 1 |
27948 | 62 | H | 5.5453 | |
30456 | 234 | H | 5.526 | 1 |
30584 | 131 | H | 4.602 | 9 |
34487 | 51 | H | 5.460 | 1 |
50089 | 113 | H | 5.926 | 1 |
50089 | 64 | H | 5.873 | 1 |
50258 | 23 | H | 5.738 | 1 |
50298 | 24 | H | 5.422 | 1 |
50971 | 40 | H | 5.743 | 1 |
51495 | 78 | H | 5.582 | 1 |
51992 | 144 | H | 5.836 | 1 |