Orotate
Simulation outputs:
|
Parameter | Value |
| Field strength | 400.13(MHz) | |
| RMSD of the fit | 0.01298 | |
| Temperature | 298 K | |
| pH | 7.4 | |
| InChI | InChI=1S/C5H4N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11) | |
| Note 1 | Very low concentratrion |
Sample description:
| Compound | Type | Concentration |
|---|---|---|
| Orotate | Solute | Saturated1 |
| D2O | Solvent | 100% |
| sodium phosphate | Buffer | 50mM |
| sodium azide | Cytocide | 500uM |
| DSS | Reference | 500uM |
Spin System Matrix
| 12 | |
|---|---|
| 12 | 6.177 |
Spectra
Select field strength to view simulated spectra and peak lists (standard and GSD): Autoscale
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| PPM | Amplitude | Peak Type |
|---|---|---|
| 6.17732 | 1.0 | standard |
| -0.804954 | 1.125e-06 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |
| 6.17732 | 1.0 | standard |