Average chemical shift: 50.342
Standard deviation: 3.178
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
1734 | 25 | CD | 61.5 | 1 |
4078 | 59 | CD | 59.9 | 1 |
4150 | 31 | CD | 90.027 | |
4150 | 8 | CD | 89.499 | |
4150 | 9 | CD | 89.795 | |
5179 | 14 | CD | 98.180 | |
5179 | 26 | CD | 98.280 | |
5179 | 27 | CD | 98.080 | |
5179 | 28 | CD | 97.580 | |
5179 | 29 | CD | 96.780 | |
5179 | 40 | CD | 98.380 | |
5179 | 70 | CD | 96.880 | |
5179 | 76 | CD | 98.580 | |
6144 | 9 | CD | 66.221 | 1 |
19858 | 46 | CD | 64.547 | 1 |
25442 | 4 | CD | 350.648 | |
25442 | 6 | CD | 350.145 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4078 | 112 | CD | 35.8 | 1 |
4202 | 62 | CD | 34.0 | 1 |
4284 | 66 | CD | 40.442 | 1 |
4781 | 31 | CD | 4.987 | 1 |
4912 | 52 | CD | 26.9600 | 1 |
5631 | 21 | CD | 14.50 | 1 |
5631 | 37 | CD | 13.60 | 1 |
5631 | 40 | CD | 14.50 | 1 |
5631 | 52 | CD | 15.70 | 1 |
5631 | 55 | CD | 14.00 | 1 |
5631 | 62 | CD | 14.80 | 1 |
5820 | 29 | CD | 40.046 | |
6571 | 34 | CD | 40.133 | 1 |
6723 | 108 | CD | 26.733 | |
6723 | 128 | CD | 27.099 | |
7121 | 122 | CD | 21.1 | 1 |
7178 | 66 | CD | 22.0 | 1 |
11175 | 126 | CD | 19.909 | 1 |
11495 | 117 | CD | 35.431 | 1 |
15083 | 24 | CD | 26.264 | 1 |
15084 | 24 | CD | 15.000 | 1 |
15084 | 36 | CD | 16.100 | 1 |
15129 | 15 | CD | 23.162 | 1 |
15433 | 17 | CD | 40.700 | 1 |
15434 | 17 | CD | 40.700 | 1 |
15873 | 11 | CD | 32.315 | 1 |
15873 | 19 | CD | 31.561 | 1 |
15873 | 21 | CD | 31.235 | 1 |
15873 | 26 | CD | 32.291 | 1 |
15873 | 53 | CD | 30.980 | 1 |
15874 | 11 | CD | 32.315 | 1 |
15874 | 19 | CD | 31.561 | 1 |
15874 | 21 | CD | 31.235 | 1 |
15874 | 26 | CD | 32.291 | 1 |
15874 | 53 | CD | 30.980 | 1 |
16068 | 55 | CD | 26.900 | 1 |
16068 | 87 | CD | 27.000 | 1 |
16534 | 27 | CD | 37.340 | 1 |
17103 | 54 | CD | 20.329 | 1 |
19087 | 107 | CD | 37.0759 | 1 |
19114 | 6 | CD | 27.181 | |
25240 | 96 | CD | 26.918 | 1 |
25679 | 33 | CD | 1.155 | |
28131 | 25 | CD | 36.92 | 1 |
30133 | 119 | CD | 36.265 | 9 |
50022 | 27 | CD | 27.139 |