Average chemical shift: 115.323
Standard deviation: 4.682
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4011 | 3 | N | 129.6 | 9 |
4035 | 42 | N | 130.44 | 1 |
4242 | 90 | N | 130.9 | 1 |
4373 | 88 | N | 131.78 | 1 |
4497 | 27 | N | 131.94 | |
4599 | 27 | N | 131.94 | |
4602 | 21 | N | 132.2 | 1 |
4678 | 65 | N | 131.44 | |
4681 | 85 | N | 132.0 | |
4681 | 85 | N | 132.2 | |
4682 | 85 | N | 132.3 | |
4682 | 85 | N | 132.5 | |
4695 | 95 | N | 130.3 | 1 |
4704 | 145 | N | 132.800 | 1 |
4784 | 48 | N | 130.24 | 1 |
4954 | 71 | N | 131.28 | 1 |
5048 | 85 | N | 130.6 | 1 |
5062 | 184 | N | 132.55 | 1 |
5062 | 80 | N | 132.55 | 1 |
5182 | 143 | N | 129.69 | 1 |
5261 | 79 | N | 131.316 | 1 |
5284 | 67 | N | 132.8 | 1 |
5285 | 67 | N | 132.8 | 1 |
5319 | 85 | N | 130.7 | 1 |
5366 | 111 | N | 130.618 | 1 |
5366 | 50 | N | 130.830 | 1 |
5382 | 113 | N | 131.03 | |
5506 | 106 | N | 130.89 | 1 |
5506 | 21 | N | 131.69 | 1 |
5514 | 97 | N | 130.23 | 1 |
5540 | 11 | N | 131.9 | 1 |
5541 | 58 | N | 131.1 | 9 |
5566 | 128 | N | 132.31 | 1 |
5571 | 11 | N | 131.4 | 1 |
5578 | 84 | N | 134.0 | |
5579 | 84 | N | 134.0 | |
5659 | 39 | N | 130.270 | 1 |
5815 | 19 | N | 211.5 | 1 |
5815 | 36 | N | 159.6 | 1 |
5815 | 46 | N | 210.5 | 1 |
5877 | 13 | N | 217.8 | |
5936 | 113 | N | 130.82 | 1 |
6026 | 49 | N | 139.0 | 1 |
6026 | 54 | N | 164.0 | 1 |
6035 | 74 | N | 132.9 | 1 |
6059 | 45 | N | 129.698 | |
6150 | 95 | N | 130.812 | 1 |
6184 | 128 | N | 129.801 | 1 |
6376 | 133 | N | 133.117 | 1 |
6439 | 78 | N | 129.987 | 1 |
6597 | 90 | N | 129.740 | 1 |
6602 | 129 | N | 130.501 | 1 |
6659 | 7 | N | 358 | 1 |
6660 | 7 | N | 360 | 1 |
6661 | 7 | N | 260 | 1 |
6662 | 7 | N | 279 | 1 |
6663 | 7 | N | 402 | 1 |
6664 | 7 | N | 256 | 1 |
6665 | 7 | N | 338 | 1 |
6666 | 7 | N | 243 | 1 |
6667 | 7 | N | 367 | 1 |
6668 | 7 | N | 283 | 1 |
6669 | 7 | N | 285 | 1 |
6670 | 7 | N | 285 | 1 |
6671 | 7 | N | 341 | 1 |
6672 | 7 | N | 266 | 1 |
6673 | 7 | N | 345 | 1 |
6674 | 7 | N | 272 | 1 |
6675 | 7 | N | 368 | 1 |
6676 | 7 | N | 288 | 1 |
6677 | 7 | N | 346 | 1 |
6678 | 7 | N | 310 | 1 |
6695 | 206 | N | 129.83 | 1 |
6730 | 18 | N | 132.874 | |
6920 | 63 | N | 133.3 | 1 |
7117 | 24 | N | 129.8 | 1 |
7430 | 65 | N | 129.658 | 1 |
10056 | 37 | N | 138.274 | 1 |
10095 | 35 | N | 134.148 | 1 |
11208 | 25 | N | 141.606 | 1 |
11384 | 34 | N | 131.080 | 1 |
11442 | 150 | N | 129.584 | 1 |
11467 | 98 | N | 131.021 | 1 |
11547 | 9 | N | 133.650 | 1 |
15009 | 100 | N | 132.441 | 1 |
15028 | 15 | N | 131.269 | 1 |
15433 | 102 | N | 129.985 | 1 |
15434 | 102 | N | 129.985 | 1 |
15545 | 82 | N | 130.619 | |
15581 | 37 | N | 129.410 | 1 |
15692 | 21 | N | 177.990 | 1 |
15734 | 101 | N | 130.637 | 1 |
15741 | 171 | N | 129.806 | 1 |
15877 | 9 | N | 149.503 | 1 |
15881 | 26 | N | 130.226 | 1 |
15881 | 5 | N | 130.015 | 1 |
15881 | 6 | N | 133.969 | 1 |
15881 | 89 | N | 130.211 | 1 |
15954 | 76 | N | 132.459 | 1 |
15964 | 65 | N | 129.733 | 1 |
16229 | 28 | N | 130.949 | 1 |
16270 | 106 | N | 133.76 | 1 |
16447 | 190 | N | 130.790 | 1 |
16451 | 190 | N | 131.270 | 1 |
16464 | 190 | N | 130.670 | 1 |
16575 | 34 | N | 131.452 | 1 |
16840 | 97 | N | 129.434 | 1 |
16937 | 250 | N | 131.156 | 1 |
17005 | 33 | N | 132.104 | 1 |
17376 | 219 | N | 131.816 | 1 |
17551 | 50 | N | 131.707 | 1 |
17596 | 14 | N | 137.116 | 1 |
17668 | 40 | N | 135.586 | 1 |
17736 | 54 | N | 130.3 | 1 |
17828 | 19 | N | 129.632 | 1 |
17829 | 122 | N | 130.204 | 1 |
17911 | 15 | N | 130.379 | 1 |
18103 | 224 | N | 129.617 | 1 |
18234 | 111 | N | 130.47 | 1 |
18250 | 78 | N | 130.040 | 1 |
18373 | 150 | N | 133.402 | 1 |
18375 | 99 | N | 130.16 | 1 |
18541 | 79 | N | 130.898 | 1 |
18682 | 150 | N | 132.715 | |
18775 | 135 | N | 133.056 | 1 |
19082 | 206 | N | 131.9570 | 1 |
19160 | 106 | N | 129.527 | 1 |
19214 | 84 | N | 129.502 | 1 |
19299 | 42 | N | 129.925 | 1 |
19395 | 26 | N | 131.812 | |
19843 | 38 | N | 129.769 | |
19855 | 3 | N | 137.305 | 1 |
19855 | 8 | N | 134.375 | 1 |
19857 | 3 | N | 130.219 | 1 |
19857 | 7 | N | 133.594 | 1 |
19857 | 8 | N | 131.469 | 1 |
19858 | 3 | N | 132.344 | 1 |
19867 | 84 | N | 223.0 | |
19867 | 89 | N | 215.8 | |
19880 | 49 | N | 131.752 | |
19880 | 49 | N | 131.810 | |
19927 | 111 | N | 131.510 | 1 |
19958 | 73 | N | 130.519 | |
19992 | 244 | N | 129.644 | 1 |
25259 | 107 | N | 131.118 | 1 |
25385 | 28 | N | 130.0099 | 1 |
25467 | 85 | N | 129.870 | 1 |
25553 | 41 | N | 130.421 | 1 |
25642 | 118 | N | 131.55 | |
25731 | 557 | N | 132.226 | |
25969 | 35 | N | 129.807 | |
26312 | 51 | N | 130.837 | 1 |
26715 | 16 | N | 131.300 | 1 |
26745 | 85 | N | 131.721 | 1 |
26855 | 138 | N | 130.807 | 1 |
26900 | 16 | N | 131.23 | 1 |
26977 | 168 | N | 130.729 | 1 |
27141 | 36 | N | 131.821 | 1 |
27381 | 29 | N | 134.296 | 1 |
27462 | 12 | N | 131.637 | |
27463 | 12 | N | 131.325 | |
27467 | 43 | N | 130.838 | |
27511 | 52 | N | 130.903 | |
27512 | 13 | N | 132.015 | |
27691 | 47 | N | 129.522 | 1 |
27975 | 26 | N | 130.0943 | |
27976 | 26 | N | 130.0943 | |
28043 | 144 | N | 130.46 | 1 |
30043 | 112 | N | 131.51 | 1 |
30208 | 45 | N | 134.618 | 1 |
30375 | 156 | N | 131.017 | |
30570 | 174 | N | 132.178 | 1 |
30570 | 75 | N | 131.584 | 1 |
30791 | 40 | N | 130.693 | 1 |
31104 | 22 | N | 222.6 | |
31104 | 27 | N | 206.3 | |
34178 | 48 | N | 132.600 | 1 |
34468 | 14 | N | 129.739 | 1 |
36077 | 32 | N | 130.021 | 1 |
36078 | 32 | N | 130.164 | 1 |
36161 | 27 | N | 130.0100 | 1 |
36489 | 65 | N | 131.342 | 1 |
50680 | 50 | N | 131.422 | |
50691 | 9 | N | 131.422 | |
50771 | 115 | N | 130.628 | 1 |
50772 | 115 | N | 130.632 | 1 |
51519 | 47 | N | 131.551 | 1 |
51676 | 195 | N | 131.577 | 1 |
51677 | 195 | N | 131.181 | 1 |
51681 | 87 | N | 132.790 | |
52152 | 149 | N | 131.2878913 | 1 |
52153 | 149 | N | 131.9384148 | 1 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4022 | 169 | N | 97.7 | 1 |
4028 | 101 | N | 100.97 | 1 |
4143 | 66 | N | 101.242 | 1 |
4171 | 30 | N | 100.3 | 1 |
4206 | 107 | N | 99.1400 | 1 |
4329 | 117 | N | 99.65 | 1 |
5159 | 103 | N | 100.8 | 1 |
5387 | 9 | N | 101.1 | 1 |
5462 | 54 | N | 100.5 | 1 |
5483 | 122 | N | 101.0 | 1 |
5658 | 108 | N | 101.1 | 1 |
5876 | 19 | N | 100.489 | 1 |
5898 | 34 | N | 99.6 | 1 |
5939 | 89 | N | 100.278 | 1 |
6003 | 105 | N | 98.682 | 1 |
6073 | 111 | N | 98.54 | |
6297 | 74 | N | 100.249 | 1 |
6304 | 44 | N | 100.178 | 1 |
6331 | 96 | N | 98.303 | 1 |
6480 | 41 | N | 100.718 | |
6481 | 41 | N | 100.711 | |
6482 | 41 | N | 100.580 | |
6483 | 41 | N | 100.726 | |
6584 | 119 | N | 101.236 | 1 |
6631 | 31 | N | 100.336 | 1 |
6722 | 71 | N | 100.304 | 1 |
6782 | 46 | N | 98.2 | 1 |
6922 | 11 | N | 100.118 | 1 |
7016 | 35 | N | 0.2 | |
7016 | 4 | N | 0.2 | |
7016 | 42 | N | 0.2 | |
7016 | 71 | N | 0.2 | |
7063 | 47 | N | 100.01 | 1 |
7130 | 52 | N | 101.010 | 1 |
7274 | 46 | N | 99.826 | 1 |
7365 | 40 | N | 100.77 | 1 |
7375 | 597 | N | 100.755 | 1 |
7428 | 59 | N | 100.1 | 1 |
10062 | 40 | N | 99.8 | 1 |
10070 | 64 | N | 100.939 | 1 |
10075 | 32 | N | 98.709 | 1 |
10076 | 42 | N | 99.321 | 1 |
10102 | 30 | N | 97.474 | 1 |
10260 | 22 | N | 95.772 | 1 |
10316 | 88 | N | 100.305 | 1 |
11042 | 36 | N | 101.170 | 1 |
11103 | 22 | N | 96.999 | 1 |
11121 | 32 | N | 97.834 | 1 |
11125 | 22 | N | 95.770 | 1 |
11152 | 32 | N | 101.048 | 1 |
11203 | 112 | N | 100.889 | 1 |
11290 | 22 | N | 98.525 | 1 |
11292 | 32 | N | 101.212 | 1 |
11304 | 32 | N | 97.846 | 1 |
11399 | 60 | N | 100.267 | 1 |
11458 | 60 | N | 100.827 | 1 |
11493 | 157 | N | 101.27 | 1 |
11494 | 157 | N | 101.246 | 1 |
12026 | 23 | N | 96.548 | 1 |
15164 | 597 | N | 100.894 | 1 |
15762 | 38 | N | 100.389 | 1 |
16146 | 59 | N | 100.262 | 1 |
16251 | 62 | N | 101.223 | 1 |
16355 | 75 | N | 100.700 | 1 |
16600 | 62 | N | 98.5 | 1 |
16611 | 41 | N | 100.406 | 1 |
16618 | 16 | N | 100.885 | 1 |
16673 | 156 | N | 100.504 | 1 |
16737 | 83 | N | 98.24 | 1 |
16790 | 59 | N | 99.630 | 1 |
16885 | 9 | N | 100.712 | 1 |
16940 | 105 | N | 97.73 | 1 |
17270 | 100 | N | 101.007 | 1 |
17481 | 126 | N | 100.739 | 1 |
17502 | 72 | N | 100.925 | 1 |
17523 | 30 | N | 99.634 | 1 |
17660 | 117 | N | 100.734 | 1 |
17727 | 53 | N | 98.895 | |
17744 | 53 | N | 98.895 | 1 |
18029 | 86 | N | 99.5 | 1 |
18266 | 115 | N | 100.185 | 1 |
18533 | 70 | N | 100.66 | 1 |
18547 | 52 | N | 100.1 | 1 |
18647 | 186 | N | 100.8151 | 1 |
18994 | 53 | N | 101.175 | 1 |
19001 | 81 | N | 98.633 | 9 |
19014 | 79 | N | 99.772 | 1 |
19235 | 22 | N | 100.722 | 1 |
19305 | 114 | N | 100.665 | 1 |
19306 | 114 | N | 100.665 | 1 |
19454 | 15 | N | 66.6 | 1 |
19454 | 21 | N | 47.8 | 1 |
19455 | 15 | N | 68.9 | 1 |
19455 | 21 | N | 50.2 | 1 |
19456 | 21 | N | 43.8 | 1 |
19457 | 21 | N | 41.1 | 1 |
19681 | 183 | N | 100.063 | 1 |
19718 | 17 | N | 0.0 | 1 |
19737 | 176 | N | 99.768 | 1 |
19826 | 106 | N | 100.190 | 1 |
19842 | 130 | N | 100.120 | 1 |
19855 | 70 | N | 93.750 | 1 |
19976 | 151 | N | 101.244 | 1 |
25003 | 151 | N | 101.183 | |
25063 | 57 | N | 99.520 | 1 |
25132 | 111 | N | 100.594 | 1 |
25156 | 123 | N | 99.2 | 1 |
25176 | 26 | N | 29.61 | |
25176 | 28 | N | 34.389 | |
25176 | 36 | N | 26.103 | |
25176 | 38 | N | 34.069 | |
25176 | 40 | N | 33.926 | |
25176 | 43 | N | 41.131 | |
25176 | 47 | N | 41 | |
25176 | 5 | N | 45.514 | |
25299 | 41 | N | 99.798 | 1 |
25496 | 12 | N | 100.949 | 1 |
25564 | 24 | N | 97.756 | 1 |
25576 | 55 | N | 100.263 | 1 |
25602 | 35 | N | 100.600 | |
25681 | 29 | N | 2.966 | |
25766 | 62 | N | 97.035 | 1 |
25808 | 20 | N | 98.6800 | 1 |
25821 | 151 | N | 100.673 | 1 |
26574 | 35 | N | 101.259 | |
26650 | 39 | N | 101.189 | 1 |
26694 | 35 | N | 100.8 | 1 |
26695 | 35 | N | 100.9 | 1 |
26767 | 50 | N | 100.764 | |
26927 | 53 | N | 101.181 | 1 |
26950 | 67 | N | 100.079 | 1 |
26952 | 67 | N | 98.411 | 1 |
26969 | 65 | N | 100.702 | 1 |
27043 | 94 | N | 99.036 | 1 |
27051 | 62 | N | 100.366 | 1 |
27162 | 78 | N | 99.242 | 1 |
27219 | 54 | N | 97.27 | 1 |
27220 | 54 | N | 98.30 | 1 |
27347 | 70 | N | 98.601 | |
27477 | 24 | N | 99.7982 | 1 |
27522 | 76 | N | 100.093 | 1 |
27563 | 170 | N | 99.876 | 1 |
27573 | 53 | N | 100.357 | 1 |
27606 | 23 | N | 97.427 | 1 |
27612 | 112 | N | 99.751 | 1 |
27640 | 13 | N | 100.934 | 1 |
27676 | 74 | N | 98.13 | 1 |
27678 | 74 | N | 99.7 | 1 |
27679 | 74 | N | 99.26 | 1 |
27680 | 74 | N | 98.22 | 1 |
27726 | 161 | N | 100.94 | 1 |
27793 | 78 | N | 99.244 | 1 |
27859 | 169 | N | 99.6 | |
27930 | 83 | N | 95.262 | |
28052 | 117 | N | 99.87075 | 1 |
30066 | 66 | N | 101.151 | |
30074 | 103 | N | 101.100 | 1 |
30247 | 66 | N | 99.328 | |
30326 | 170 | N | 100.882 | 1 |
30615 | 21 | N | 43.60 | 1 |
30616 | 15 | N | 70.90 | 1 |
30616 | 21 | N | 49.40 | 1 |
30957 | 28 | N | 100.60 | 1 |
30957 | 28 | N | 100.7 | 1 |
34201 | 22 | N | 98.710 | 1 |
34308 | 168 | N | 98.590 | 1 |
34379 | 106 | N | 100.213 | 1 |
34461 | 146 | N | 97.590 | 1 |
34471 | 52 | N | 98.411 | |
34472 | 53 | N | 98.411 | |
34643 | 34 | N | 100.363 | 1 |
34781 | 27 | N | 101.228 | 1 |
36000 | 55 | N | 100.257 | 1 |
36008 | 55 | N | 100.284 | 1 |
50107 | 146 | N | 97.532 | 1 |
50212 | 48 | N | 100.38 | 1 |
50305 | 45 | N | 97.054 | 1 |
50355 | 80 | N | 100.672 | 1 |
50357 | 80 | N | 99.935 | 1 |
50411 | 28 | N | 100.945 | 1 |
50411 | 28 | N | 100.977 | 1 |
50466 | 20 | N | 98.43773 | 1 |
50467 | 20 | N | 98.43426 | 1 |
50468 | 20 | N | 99.04943 | 1 |
50751 | 129 | N | 100.746 | 1 |
50778 | 9 | N | 99.4 | |
50801 | 97 | N | 100.525 | |
50802 | 97 | N | 100.316 | |
50903 | 144 | N | 99.546 | 1 |
50945 | 59 | N | 98.600 | 1 |
50948 | 40 | N | 98.669 | |
50949 | 53 | N | 100.437 | |
51180 | 74 | N | 98.0 | |
51180 | 74 | N | 98.13 | |
51180 | 74 | N | 98.46 | |
51181 | 74 | N | 98.01 | |
51181 | 74 | N | 98.49 | |
51181 | 74 | N | 98.52 | |
51181 | 74 | N | 99.45 | |
51639 | 228 | N | 99.601 | 1 |
51657 | 12 | N | 95.703 | 1 |
51658 | 12 | N | 95.615 | 1 |
52003 | 12 | N | 95.707 | |
52004 | 12 | N | 95.644 | |
52143 | 146 | N | 100.65 | 1 |