4-Chlorofuro[3,2-c]pyridine
Simulation outputs:
|
Parameter | Value |
| Field strength | 600.01(MHz) | |
| RMSD of the fit | 0.02670 | |
| Temperature | 298 K | |
| pH | 7.4 | |
| InChI | InChI=1S/C7H4ClNO/c8-7-5-2-4-10-6(5)1-3-9-7/h1-4H | |
| Note 1 | 12?14 | |
| Note 2 | 11?13 |
Sample description:
| Compound | Type | Concentration |
|---|---|---|
| 4-Chlorofuro[3,2-c]pyridine | Solute | 75uM |
| DSS | Reference | 15uM |
| bis-Tris-d19 | Buffer | 11mM |
| NaCl | . | 150mM |
| NaN3 | . | 0.04%. |
| Na Formate | . | 200uM |
Spin System Matrix
| 11 | 12 | 13 | 14 | |
|---|---|---|---|---|
| 11 | 7.628 | 0 | 6.357 | 0 |
| 12 | 0 | 7.064 | 0 | 2.403 |
| 13 | 0 | 0 | 8.232 | 0 |
| 14 | 0 | 0 | 0 | 7.923 |
Spectra
Select field strength to view simulated spectra and peak lists (standard and GSD): Autoscale
Help
To zoom into a region, draw a box around it.Hover over the x/y-axis and use mouse-wheel to zoom in/out.
Hover over the x/y-axis hold down left-button to move around the spectra.
(De)activate a spectrum by clicking on its legend.
| PPM | Amplitude | Peak Type |
|---|---|---|
| 7.06235 | 0.990653 | standard |
| 7.06564 | 0.990654 | standard |
| 7.62279 | 0.80704 | standard |
| 7.63334 | 0.807048 | standard |
| 7.92182 | 1.00002 | standard |
| 7.92497 | 1.00002 | standard |
| 8.22723 | 0.807015 | standard |
| 8.23778 | 0.807007 | standard |
| 7.04033 | 0.88782 | standard |
| 7.08808 | 0.952219 | standard |
| 7.53918 | 0.594756 | standard |
| 7.69729 | 0.956954 | standard |
| 7.89919 | 1.0 | standard |
| 7.94731 | 0.935119 | standard |
| 8.16323 | 0.94861 | standard |
| 8.32136 | 0.586098 | standard |
| 7.04809 | 0.936218 | standard |
| 7.08007 | 0.980941 | standard |
| 7.57093 | 0.665778 | standard |
| 7.67626 | 0.913235 | standard |
| 7.90735 | 1.0 | standard |
| 7.93936 | 0.955255 | standard |
| 8.18422 | 0.909857 | standard |
| 8.28954 | 0.662225 | standard |
| 7.05211 | 0.956963 | standard |
| 7.07598 | 0.990873 | standard |
| 7.58606 | 0.701497 | standard |
| 7.66505 | 0.888908 | standard |
| 7.91133 | 1.0 | standard |
| 7.93536 | 0.965969 | standard |
| 8.19552 | 0.887049 | standard |
| 8.27451 | 0.699555 | standard |
| 7.05338 | 0.961657 | standard |
| 7.07469 | 0.991987 | standard |
| 7.59098 | 0.713142 | standard |
| 7.66119 | 0.880147 | standard |
| 7.91275 | 1.0 | standard |
| 7.93406 | 0.969681 | standard |
| 8.19938 | 0.878693 | standard |
| 8.26959 | 0.711624 | standard |
| 7.05445 | 0.966201 | standard |
| 7.07362 | 0.993568 | standard |
| 7.59481 | 0.722589 | standard |
| 7.65803 | 0.873216 | standard |
| 7.91382 | 1.0 | standard |
| 7.93299 | 0.972648 | standard |
| 8.20244 | 0.872046 | standard |
| 8.26566 | 0.721369 | standard |
| 7.0592 | 0.99841 | standard |
| 7.06879 | 0.998422 | standard |
| 7.61185 | 0.771151 | standard |
| 7.64351 | 0.847703 | standard |
| 7.91865 | 1.0 | standard |
| 7.92824 | 0.999991 | standard |
| 8.21707 | 0.847638 | standard |
| 8.24862 | 0.771106 | standard |
| 7.06077 | 0.999297 | standard |
| 7.06722 | 0.999301 | standard |
| 7.61737 | 0.785192 | standard |
| 7.63848 | 0.836325 | standard |
| 7.92022 | 1.0 | standard |
| 7.92667 | 0.999997 | standard |
| 8.2221 | 0.836195 | standard |
| 8.24321 | 0.785059 | standard |
| 7.06156 | 0.993441 | standard |
| 7.06643 | 0.993443 | standard |
| 7.62003 | 0.787688 | standard |
| 7.63591 | 0.825878 | standard |
| 7.92103 | 1.00002 | standard |
| 7.92575 | 1.00002 | standard |
| 8.22466 | 0.826272 | standard |
| 8.24044 | 0.788106 | standard |
| 7.06203 | 0.992056 | standard |
| 7.06596 | 0.992057 | standard |
| 7.62171 | 0.791997 | standard |
| 7.63433 | 0.822531 | standard |
| 7.92151 | 1.0 | standard |
| 7.92528 | 0.999999 | standard |
| 8.22614 | 0.821898 | standard |
| 8.23887 | 0.79134 | standard |
| 7.06235 | 0.990653 | standard |
| 7.06564 | 0.990654 | standard |
| 7.62279 | 0.807037 | standard |
| 7.63334 | 0.807044 | standard |
| 7.92182 | 1.00002 | standard |
| 7.92497 | 1.00002 | standard |
| 8.22723 | 0.807012 | standard |
| 8.23778 | 0.807004 | standard |
| 7.06259 | 0.989194 | standard |
| 7.0654 | 0.989194 | standard |
| 7.62358 | 0.805193 | standard |
| 7.63255 | 0.805198 | standard |
| 7.92207 | 1.00013 | standard |
| 7.92472 | 1.00013 | standard |
| 8.22792 | 0.804331 | standard |
| 8.237 | 0.804326 | standard |
| 7.06266 | 0.988613 | standard |
| 7.06533 | 0.988613 | standard |
| 7.62387 | 0.807674 | standard |
| 7.63226 | 0.807678 | standard |
| 7.92214 | 1.00014 | standard |
| 7.92465 | 1.00014 | standard |
| 8.22822 | 0.806755 | standard |
| 8.2367 | 0.806751 | standard |
| 7.06274 | 0.987778 | standard |
| 7.06525 | 0.987779 | standard |
| 7.62407 | 0.807287 | standard |
| 7.63196 | 0.80729 | standard |
| 7.92222 | 1.00002 | standard |
| 7.92457 | 1.00002 | standard |
| 8.22851 | 0.807271 | standard |
| 8.2364 | 0.807268 | standard |
| 7.06292 | 1.00009 | standard |
| 7.06507 | 1.00009 | standard |
| 7.62457 | 0.811342 | standard |
| 7.63157 | 0.811345 | standard |
| 7.92237 | 1.00017 | standard |
| 7.92452 | 1.00017 | standard |
| 8.22891 | 0.810253 | standard |
| 8.23601 | 0.810251 | standard |
| 7.06302 | 1.00016 | standard |
| 7.06496 | 1.00016 | standard |
| 7.62476 | 0.804703 | standard |
| 7.63137 | 0.804705 | standard |
| 7.92235 | 0.985696 | standard |
| 7.92444 | 0.985696 | standard |
| 8.2291 | 0.803553 | standard |
| 8.23581 | 0.803551 | standard |
| 7.0631 | 1.00052 | standard |
| 7.06499 | 1.00052 | standard |
| 7.62486 | 0.806523 | standard |
| 7.63127 | 0.806524 | standard |
| 7.92245 | 1.00058 | standard |
| 7.92434 | 1.00058 | standard |
| 8.2293 | 0.807696 | standard |
| 8.23561 | 0.807695 | standard |
| 7.06323 | 0.979688 | standard |
| 7.06476 | 0.979688 | standard |
| 7.62565 | 0.799853 | standard |
| 7.63048 | 0.799854 | standard |
| 7.92271 | 1.00003 | standard |
| 7.92408 | 1.00003 | standard |
| 8.22999 | 0.798313 | standard |
| 8.23492 | 0.798312 | standard |