Average chemical shift: 6.691
Standard deviation: 0.302
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
190 | 79 | HE1 | 7.75 | 1 |
1394 | 91 | HE1 | 8.62 | 1 |
1538 | 12 | HE1 | 7.63 | 1 |
1539 | 12 | HE1 | 7.63 | 1 |
1543 | 12 | HE1 | 7.63 | 1 |
1544 | 12 | HE1 | 7.63 | 1 |
1545 | 12 | HE1 | 7.68 | 1 |
1546 | 12 | HE1 | 7.68 | 1 |
1646 | 53 | HE1 | 8.23 | 3 |
1647 | 53 | HE1 | 7.93 | 1 |
2352 | 64 | HE1 | 11.8 | 3 |
4321 | 161 | HE1 | 7.86 | 1 |
4435 | 69 | HE1 | 8.02 | 1 |
4901 | 49 | HE1 | 7.68 | 1 |
5026 | 67 | HE1 | 8.65 | |
5129 | 25 | HE1 | 7.608 | 1 |
5325 | 48 | HE1 | 7.633 | 3 |
5880 | 83 | HE1 | 7.706 | 2 |
6073 | 54 | HE1 | 7.60 | |
6444 | 138 | HE1 | 9.035 | |
6953 | 66 | HE1 | 7.829 | 1 |
7142 | 66 | HE1 | 7.829 | 1 |
7209 | 48 | HE1 | 7.612 | 1 |
7381 | 35 | HE1 | 7.601 | 3 |
11299 | 11 | HE1 | 7.663 | 1 |
11299 | 17 | HE1 | 7.681 | 1 |
11299 | 59 | HE1 | 7.771 | 1 |
15120 | 133 | HE1 | 7.671 | |
15382 | 32 | HE1 | 7.71 | |
15399 | 66 | HE1 | 7.829 | 1 |
15401 | 35 | HE1 | 7.601 | 3 |
16616 | 67 | HE1 | 7.785 | 3 |
17278 | 87 | HE1 | 7.758 | 3 |
17903 | 72 | HE1 | 7.800 | |
18011 | 128 | HE1 | 7.712 | 3 |
19638 | 53 | HE1 | 8.299 | |
19834 | 6 | HE1 | 7.763 | |
25371 | 66 | HE1 | 7.782 | |
25681 | 27 | HE1 | 9.182 | |
26065 | 5 | HE1 | 7.852 | |
27434 | 264 | HE1 | 11.7 | 1 |
27925 | 66 | HE1 | 8.0400 | 3 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
94 | 12 | HE1 | 5.77 | 3 |
94 | 9 | HE1 | 5.77 | 3 |
95 | 11 | HE1 | 5.77 | 3 |
95 | 8 | HE1 | 5.77 | 3 |
274 | 97 | HE1 | 5.73 | 1 |
346 | 51 | HE1 | 5.07 | 1 |
759 | 27 | HE1 | 4.53 | 1 |
923 | 51 | HE1 | 5.48 | 3 |
1163 | 155 | HE1 | 2.83 | 1 |
1163 | 29 | HE1 | 2.91 | 1 |
1163 | 68 | HE1 | 2.92 | 1 |
1163 | 85 | HE1 | 2.8 | 1 |
1164 | 155 | HE1 | 2.87 | 1 |
1164 | 29 | HE1 | 2.92 | 1 |
1164 | 68 | HE1 | 2.87 | 1 |
1164 | 85 | HE1 | 2.81 | 1 |
1165 | 155 | HE1 | 2.8 | 1 |
1165 | 29 | HE1 | 2.92 | 1 |
1165 | 68 | HE1 | 2.88 | 1 |
1165 | 85 | HE1 | 2.81 | 1 |
1166 | 155 | HE1 | 2.61 | 1 |
1166 | 29 | HE1 | 2.79 | 1 |
1166 | 68 | HE1 | 2.91 | 1 |
1166 | 85 | HE1 | 2.79 | 1 |
1167 | 155 | HE1 | 2.89 | 1 |
1167 | 29 | HE1 | 2.98 | 1 |
1167 | 68 | HE1 | 2.91 | 1 |
1167 | 85 | HE1 | 2.8 | 1 |
1168 | 155 | HE1 | 2.86 | 1 |
1168 | 29 | HE1 | 2.92 | 1 |
1168 | 68 | HE1 | 2.85 | 1 |
1168 | 85 | HE1 | 2.8 | 1 |
1334 | 27 | HE1 | 4.58 | 1 |
1346 | 155 | HE1 | 2.95 | 1 |
1346 | 29 | HE1 | 3.01 | 1 |
1346 | 68 | HE1 | 2.91 | 1 |
1346 | 85 | HE1 | 2.8 | 1 |
1347 | 155 | HE1 | 2.96 | 1 |
1347 | 29 | HE1 | 3.03 | 1 |
1347 | 68 | HE1 | 2.92 | 1 |
1347 | 85 | HE1 | 2.8 | 1 |
1348 | 155 | HE1 | 2.95 | 1 |
1348 | 29 | HE1 | 3.02 | 1 |
1348 | 68 | HE1 | 2.92 | 1 |
1348 | 85 | HE1 | 2.8 | 1 |
1580 | 94 | HE1 | 5.55 | 1 |
2198 | 80 | HE1 | 5.29 | 1 |
2396 | 138 | HE1 | 5.68 | 1 |
4067 | 11 | HE1 | 5.173 | 3 |
4078 | 66 | HE1 | 5.57 | 1 |
4115 | 54 | HE1 | 5.32 | 1 |
4189 | 67 | HE1 | 0.10 | 1 |
4189 | 97 | HE1 | 5.52 | 1 |
4291 | 66 | HE1 | 4.827 | 1 |
4327 | 120 | HE1 | 5.73 | 1 |
4340 | 84 | HE1 | 5.75 | 1 |
4435 | 46 | HE1 | 5.29 | 1 |
4436 | 46 | HE1 | 5.65 | 1 |
4436 | 69 | HE1 | 4.78 | 1 |
4727 | 58 | HE1 | 5.62 | 1 |
4761 | 13 | HE1 | 5.33 | 1 |
4777 | 46 | HE1 | 5.42 | 1 |
5029 | 41 | HE1 | 5.43 | 1 |
5269 | 65 | HE1 | 5.66 | 3 |
5275 | 132 | HE1 | 5.407 | 1 |
5296 | 55 | HE1 | 2.78 | |
5333 | 66 | HE1 | 4.77 | 1 |
5372 | 67 | HE1 | 0.08 | 1 |
5372 | 97 | HE1 | 5.50 | 1 |
5532 | 42 | HE1 | 5.676 | 1 |
5625 | 43 | HE1 | 5.36 | 1 |
5748 | 28 | HE1 | 5.710 | 1 |
5947 | 98 | HE1 | 5.690 | 1 |
6117 | 45 | HE1 | 5.51 | 2 |
6132 | 92 | HE1 | 5.74 | 1 |
6295 | 215 | HE1 | 5.722 | 3 |
6634 | 43 | HE1 | 5.46 | 1 |
6727 | 92 | HE1 | 5.775 | 1 |
6782 | 132 | HE1 | 5.78 | 1 |
7004 | 3 | HE1 | 5.77 | 1 |
7297 | 101 | HE1 | 5.448 | 1 |
7414 | 165 | HE1 | 5.776 | 1 |
10108 | 48 | HE1 | 5.712 | 3 |
10114 | 10 | HE1 | 5.663 | 1 |
10120 | 81 | HE1 | 5.324 | 1 |
11142 | 108 | HE1 | 5.596 | 1 |
11244 | 52 | HE1 | 5.776 | 1 |
11322 | 49 | HE1 | 5.726 | 1 |
11366 | 55 | HE1 | 5.593 | 1 |
11388 | 24 | HE1 | 5.290 | 1 |
11472 | 34 | HE1 | 5.753 | 3 |
11549 | 40 | HE1 | 5.757 | 3 |
16164 | 61 | HE1 | 5.000 | 1 |
16194 | 22 | HE1 | 5.716 | 3 |
16233 | 51 | HE1 | 4.983 | 3 |
16251 | 59 | HE1 | 5.496 | 1 |
16316 | 31 | HE1 | 5.71 | 3 |
16572 | 55 | HE1 | 5.59 | 3 |
16632 | 27 | HE1 | 5.001 | 3 |
16632 | 27 | HE1 | 5.002 | 3 |
16674 | 65 | HE1 | 5.109 | 3 |
17111 | 85 | HE1 | 5.642 | 1 |
17370 | 46 | HE1 | 5.38 | 3 |
17420 | 20 | HE1 | 5.344 | 3 |
17447 | 98 | HE1 | 5.720 | 3 |
17518 | 86 | HE1 | 5.775 | 2 |
17754 | 19 | HE1 | 5.71 | 3 |
17903 | 51 | HE1 | 3.491 | |
17957 | 79 | HE1 | 5.7650 | 3 |
18422 | 21 | HE1 | 5.61 | 3 |
18782 | 12 | HE1 | 5.657 | 3 |
18853 | 132 | HE1 | 5.671 | 3 |
18899 | 122 | HE1 | 5.716 | 3 |
19169 | 93 | HE1 | 4.967 | 3 |
19292 | 17 | HE1 | 5.769 | 3 |
19523 | 87 | HE1 | 5.711 | |
19589 | 151 | HE1 | 5.767 | 3 |
19638 | 51 | HE1 | 3.686 | |
19688 | 23 | HE1 | 5.739 | 1 |
19945 | 94 | HE1 | 5.460 | |
19974 | 79 | HE1 | 5.7650 | 3 |
19984 | 86 | HE1 | 5.60 | 1 |
25766 | 169 | HE1 | 5.657 | 1 |
25907 | 67 | HE1 | 3.009 | |
25908 | 46 | HE1 | 4.841 | |
25974 | 16 | HE1 | 5.760 | 1 |
26001 | 15 | HE1 | 5.741 | 1 |
26005 | 17 | HE1 | 5.758 | 3 |
26006 | 17 | HE1 | 5.773 | 3 |
26552 | 31 | HE1 | 5.748 | |
27313 | 52 | HE1 | 5.627 | 3 |
27663 | 37 | HE1 | 5.572 | 3 |
30247 | 35 | HE1 | 5.642 | |
30285 | 42 | HE1 | 5.683 | 1 |
30531 | 37 | HE1 | 5.493 | |
30784 | 32 | HE1 | 5.775 | 3 |
34022 | 6 | HE1 | 5.748 | |
34170 | 16 | HE1 | 5.760 | 1 |
34227 | 69 | HE1 | 5.583 | 1 |
34229 | 69 | HE1 | 5.583 | 1 |
34511 | 47 | HE1 | 5.004 | |
36516 | 4 | HE1 | 5.5330 | 3 |
50269 | 6 | HE1 | 5.50 | 3 |
50269 | 61 | HE1 | 5.66 | 3 |