Average chemical shift: 3.178
Standard deviation: 0.35
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
2950 | 58 | HB2 | 4.54 | 1 |
4435 | 68 | HB2 | 5.35 | 1 |
16018 | 71 | HB2 | 4.377 | 1 |
19608 | 126 | HB2 | 4.323 | 2 |
25513 | 126 | HB2 | 4.291 | 2 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
1673 | 57 | HB2 | 2.06 | 1 |
2249 | 50 | HB2 | 1.99 | 2 |
2858 | 62 | HB2 | 1.89 | 1 |
3441 | 62 | HB2 | 1.82 | 1 |
4092 | 115 | HB2 | 1.87 | 2 |
4360 | 90 | HB2 | 1.34 | 2 |
4410 | 23 | HB2 | 1.33 | 2 |
4438 | 50 | HB2 | 2.01 | 2 |
4562 | 62 | HB2 | 1.82 | 1 |
4775 | 67 | HB2 | 0.42 | 1 |
4943 | 62 | HB2 | 1.84 | 1 |
5005 | 68 | HB2 | 1.98 | 2 |
5068 | 63 | HB2 | 1.83 | 2 |
5072 | 155 | HB2 | 0.875 | 2 |
5237 | 38 | HB2 | 2.096 | 1 |
5334 | 15 | HB2 | 2.070 | 2 |
5388 | 54 | HB2 | 1.86 | 2 |
5392 | 14 | HB2 | 1.93 | 1 |
5696 | 13 | HB2 | 1.97 | 2 |
5729 | 40 | HB2 | 2.04 | 1 |
5783 | 61 | HB2 | 2.099 | 1 |
5803 | 63 | HB2 | 1.91 | 2 |
5804 | 63 | HB2 | 1.95 | 2 |
5807 | 49 | HB2 | 1.28 | 2 |
5943 | 69 | HB2 | 2.115 | 2 |
5947 | 90 | HB2 | 2.024 | 2 |
6120 | 33 | HB2 | 1.99 | 1 |
6159 | 38 | HB2 | 1.510 | 2 |
6222 | 17 | HB2 | 1.81 | 1 |
6372 | 133 | HB2 | 1.92 | 1 |
6415 | 63 | HB2 | 1.84 | 2 |
6434 | 77 | HB2 | 2.080 | 2 |
6444 | 5 | HB2 | 1.880 | |
6444 | 99 | HB2 | 1.003 | |
6510 | 103 | HB2 | 1.84 | 2 |
6546 | 73 | HB2 | 1.04 | 2 |
6581 | 59 | HB2 | 2.00 | 2 |
6654 | 26 | HB2 | 1.43 | 2 |
6726 | 31 | HB2 | 2.088 | 2 |
6777 | 44 | HB2 | 2.097 | 1 |
6901 | 62 | HB2 | 1.325 | 2 |
6999 | 59 | HB2 | 2.060 | 2 |
7125 | 37 | HB2 | 1.944 | 2 |
7160 | 62 | HB2 | 1.83 | |
7273 | 28 | HB2 | 1.488 | |
10104 | 18 | HB2 | 2.114 | 2 |
10131 | 48 | HB2 | 1.800 | 2 |
11088 | 30 | HB2 | 1.421 | 2 |
11088 | 40 | HB2 | 1.873 | 2 |
11089 | 43 | HB2 | 1.622 | 2 |
11097 | 60 | HB2 | 1.957 | 2 |
11134 | 16 | HB2 | 1.690 | 2 |
11156 | 43 | HB2 | 2.077 | 2 |
11179 | 43 | HB2 | 2.034 | 2 |
11220 | 47 | HB2 | 2.111 | 2 |
11472 | 41 | HB2 | 1.592 | 2 |
11499 | 41 | HB2 | 1.780 | 2 |
11531 | 62 | HB2 | 1.355 | |
15044 | 7 | HB2 | 1.699 | |
15061 | 49 | HB2 | 1.826 | 2 |
15126 | 21 | HB2 | 1.437 | 2 |
15280 | 49 | HB2 | 1.53 | 1 |
15578 | 249 | HB2 | 1.701 | 1 |
15707 | 21 | HB2 | 1.402 | 2 |
15718 | 76 | HB2 | 1.981 | 2 |
15739 | 9 | HB2 | 1.063 | 2 |
15776 | 58 | HB2 | 1.94 | 2 |
15935 | 57 | HB2 | 2.065 | 2 |
16018 | 65 | HB2 | 1.664 | 1 |
16061 | 52 | HB2 | 2.063 | 2 |
16082 | 16 | HB2 | 1.490 | 2 |
16139 | 56 | HB2 | 1.94 | |
16163 | 68 | HB2 | 2.005 | 1 |
16266 | 58 | HB2 | 2.056 | 2 |
16305 | 116 | HB2 | 2.077 | 2 |
16466 | 29 | HB2 | 1.265 | 2 |
16549 | 14 | HB2 | 1.635 | 2 |
16549 | 18 | HB2 | 1.506 | 2 |
16642 | 40 | HB2 | 1.9810 | 2 |
16840 | 33 | HB2 | 2.050 | 2 |
16991 | 56 | HB2 | 2.045 | 2 |
17022 | 36 | HB2 | 1.610 | 2 |
17310 | 21 | HB2 | 2.123 | 2 |
17447 | 33 | HB2 | 2.025 | 2 |
17452 | 58 | HB2 | 1.8619 | 2 |
17501 | 48 | HB2 | 1.457 | 2 |
17670 | 41 | HB2 | 2.002 | 2 |
17693 | 17 | HB2 | 2.075 | 2 |
17755 | 115 | HB2 | 1.5240 | 2 |
17755 | 23 | HB2 | 1.4520 | 2 |
17960 | 105 | HB2 | 2.085 | 2 |
18098 | 89 | HB2 | 2.113 | 2 |
18249 | 97 | HB2 | 2.087 | 2 |
18387 | 88 | HB2 | 1.945 | 2 |
18415 | 73 | HB2 | 2.126 | 2 |
18569 | 89 | HB2 | 1.334 | 2 |
18882 | 153 | HB2 | 1.316 | |
18989 | 91 | HB2 | 2.1 | 2 |
19023 | 55 | HB2 | 2.054 | 2 |
19149 | 29 | HB2 | 1.450 | |
19458 | 128 | HB2 | 0.8873 | |
19541 | 9 | HB2 | 1.789 | 2 |
19775 | 114 | HB2 | 0.908 | 1 |
19807 | 110 | HB2 | 1.631 | 2 |
19807 | 119 | HB2 | 1.720 | 2 |
19906 | 11 | HB2 | 1.79 | 1 |
19945 | 57 | HB2 | 1.995 | |
21002 | 11 | HB2 | 1.90 | 2 |
21002 | 4 | HB2 | 1.94 | 2 |
21008 | 4 | HB2 | 1.849 | 2 |
21013 | 6 | HB2 | 2.000 | 2 |
25086 | 26 | HB2 | 0.678 | 2 |
25132 | 148 | HB2 | 2.023 | 1 |
25350 | 71 | HB2 | 1.960 | 1 |
25437 | 114 | HB2 | 1.434 | |
25568 | 26 | HB2 | 1.311 | 2 |
25659 | 24 | HB2 | 2.039 | 2 |
25908 | 59 | HB2 | 2.098 | |
26661 | 31 | HB2 | 2.064 | 2 |
26844 | 54 | HB2 | 1.912 | 2 |
27677 | 172 | HB2 | 1.3230 | 2 |
27725 | 67 | HB2 | 1.967 | 2 |
27925 | 88 | HB2 | 1.3390 | 2 |
30034 | 99 | HB2 | 1.76 | 2 |
30133 | 91 | HB2 | 1.931 | 9 |
30296 | 9 | HB2 | 1.616 | 2 |
30322 | 147 | HB2 | 2 | 1 |
30410 | 20 | HB2 | 1.953 | |
30557 | 3 | HB2 | 1.9836 | |
30821 | 102 | HB2 | 1.901 | 2 |
34227 | 70 | HB2 | 1.811 | 2 |
34229 | 70 | HB2 | 1.811 | 2 |
34308 | 16 | HB2 | 2.054 | 1 |
34308 | 191 | HB2 | 1.614 | 1 |
34308 | 208 | HB2 | 2.043 | 1 |
34308 | 5 | HB2 | 1.686 | 1 |
34336 | 21 | HB2 | 2.024 | |
34638 | 65 | HB2 | 1.027 | |
34792 | 31 | HB2 | 1.971 | 1 |
36048 | 33 | HB2 | 1.385 | |
36336 | 61 | HB2 | 1.847 | 1 |
51160 | 82 | HB2 | 2.036 |