Average chemical shift: 193.344
Standard deviation: 19.16
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4205 | 100 | ND1 | 255.70 | 1 |
4205 | 48 | ND1 | 255.30 | 1 |
4706 | 132 | ND1 | 255.001 | 1 |
5399 | 34 | ND1 | 254.56 | 1 |
5401 | 76 | ND1 | 256.08 | 1 |
5483 | 75 | ND1 | 256.6 | 1 |
5668 | 175 | ND1 | 251.449 | 1 |
11001 | 13 | ND1 | 253.4 | 1 |
11001 | 89 | ND1 | 251.5 | 1 |
15084 | 98 | ND1 | 253.000 | 1 |
16364 | 127 | ND1 | 256 | 1 |
16404 | 79 | ND1 | 255.0 | 1 |
16860 | 38 | ND1 | 254.0 | 1 |
17270 | 34 | ND1 | 255.789 | 1 |
17670 | 53 | ND1 | 254.349 | 1 |
17688 | 31 | ND1 | 251.305 | 1 |
17688 | 89 | ND1 | 261.013 | 1 |
17767 | 98 | ND1 | 257.700 | 1 |
18547 | 124 | ND1 | 255.4 | 1 |
18728 | 121 | ND1 | 254.201 | 1 |
25766 | 109 | ND1 | 257.152 | 1 |
25788 | 20 | ND1 | 251.069 | |
25788 | 20 | ND1 | 251.566 | |
30929 | 83 | ND1 | 253.800 | |
30930 | 83 | ND1 | 253.800 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4062 | 94 | ND1 | 64.9 | 1 |
4154 | 8 | ND1 | 126.0 | 1 |
4193 | 126 | ND1 | 115.7 | 1 |
4193 | 134 | ND1 | 115.7 | 1 |
4193 | 172 | ND1 | 111.1 | 1 |
4301 | 11 | ND1 | 106.6 | 1 |
5094 | 46 | ND1 | 118.54 | |
5094 | 72 | ND1 | 112.66 | |
5129 | 52 | ND1 | 115.9 | 2 |
5129 | 78 | ND1 | 115.7 | 2 |
5129 | 87 | ND1 | 116.1 | 2 |
5269 | 46 | ND1 | 135.6 | 1 |
5269 | 70 | ND1 | 133.8 | 1 |
5275 | 125 | ND1 | 129.809 | 1 |
5564 | 55 | ND1 | 128.99 | 1 |
5843 | 60 | ND1 | 110.1 | 1 |
6312 | 74 | ND1 | 118.165 | 1 |
6374 | 31 | ND1 | 111.13 | |
7103 | 137 | ND1 | 119.9 | 1 |
7103 | 140 | ND1 | 125.5 | 1 |
7103 | 59 | ND1 | 119.4 | 1 |
7103 | 96 | ND1 | 120.3 | 1 |
15003 | 53 | ND1 | 119.824 | 1 |
15032 | 75 | ND1 | 117.1 | 1 |
15466 | 54 | ND1 | 119.824 | 1 |
15558 | 128 | ND1 | 122.900 | 1 |
16043 | 102 | ND1 | 119.4470 | 1 |
16206 | 38 | ND1 | 115.8 | |
16248 | 103 | ND1 | 106.214 | 1 |
16248 | 87 | ND1 | 116.898 | 1 |
16306 | 69 | ND1 | 135.8 | 1 |
16307 | 69 | ND1 | 135.3 | 1 |
16465 | 107 | ND1 | 119.30 | 1 |
16465 | 26 | ND1 | 124.70 | 1 |
16466 | 37 | ND1 | 103.266 | 1 |
17062 | 23 | ND1 | 131.269 | 1 |
17063 | 23 | ND1 | 130.465 | 1 |
17456 | 65 | ND1 | 127.022 | 1 |
17751 | 100 | ND1 | 120.500 | 1 |
18124 | 44 | ND1 | 112.337 | 1 |
18331 | 79 | ND1 | 120.870 | 1 |
18607 | 7 | ND1 | 126.775 | 1 |
18828 | 26 | ND1 | 129.797 | 1 |
19946 | 62 | ND1 | 134.96 | |
25117 | 32 | ND1 | 122.153 | 1 |
25117 | 41 | ND1 | 122.269 | 1 |
25117 | 60 | ND1 | 121.906 | 1 |
25241 | 6 | ND1 | 118.74 | 1 |
25907 | 18 | ND1 | 129.987 | |
26725 | 43 | ND1 | 124.084 | |
30186 | 46 | ND1 | 31.026 | 1 |
30954 | 12 | ND1 | 115.931 | |
34773 | 10 | ND1 | 122.096 | |
34773 | 81 | ND1 | 122.681 | |
34773 | 86 | ND1 | 122.906 | |
34803 | 2 | ND1 | 121.847 | |
34803 | 3 | ND1 | 121.776 | |
34803 | 4 | ND1 | 121.882 | |
34803 | 5 | ND1 | 121.999 | |
34803 | 6 | ND1 | 120.422 | |
34803 | 69 | ND1 | 117.539 | |
34803 | 7 | ND1 | 117.927 | |
34803 | 85 | ND1 | 121.803 | |
36264 | 67 | ND1 | 126.630 | 1 |