5-Chlorothiophene-2-sulfonamide
Simulation outputs:
|
Parameter | Value |
| Field strength | 600.01(MHz) | |
| RMSD of the fit | 0.02078 | |
| Temperature | 298 K | |
| pH | 7.4 | |
| InChI | InChI=1S/C4H4ClNO2S2/c5-3-1-2-4(9-3)10(6,7)8/h1-2H,(H2,6,7,8) | |
| Note 1 | 11?12 |
Sample description:
| Compound | Type | Concentration |
|---|---|---|
| 5-Chlorothiophene-2-sulfonamide | Solute | 75uM |
| DSS | Reference | 15uM |
| bis-Tris-d19 | Buffer | 11mM |
| NaCl | . | 150mM |
| NaN3 | . | 0.04%. |
| Na Formate | . | 200uM |
Spin System Matrix
| 11 | 12 | |
|---|---|---|
| 11 | 7.094 | 4.426 |
| 12 | 0 | 7.53 |
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 |
|---|---|---|
| 7.09064 | 1.00011 | standard |
| 7.09795 | 1.00011 | standard |
| 7.52647 | 0.998921 | standard |
| 7.53387 | 0.99892 | standard |
| 7.03255 | 0.634737 | standard |
| 7.14265 | 1.0 | standard |
| 7.48186 | 1.0 | standard |
| 7.59196 | 0.634737 | standard |
| 7.05457 | 0.736919 | standard |
| 7.12799 | 0.999917 | standard |
| 7.49652 | 1.0 | standard |
| 7.56984 | 0.73704 | standard |
| 7.06511 | 0.794938 | standard |
| 7.12018 | 1.0 | standard |
| 7.50433 | 1.0 | standard |
| 7.55941 | 0.794938 | standard |
| 7.06855 | 0.815351 | standard |
| 7.11751 | 1.0 | standard |
| 7.507 | 1.0 | standard |
| 7.55596 | 0.815351 | standard |
| 7.07121 | 0.832115 | standard |
| 7.11524 | 1.0 | standard |
| 7.50928 | 1.0 | standard |
| 7.5533 | 0.832115 | standard |
| 7.08305 | 0.912142 | standard |
| 7.10506 | 1.00009 | standard |
| 7.51946 | 1.00009 | standard |
| 7.54147 | 0.912142 | standard |
| 7.08689 | 0.940524 | standard |
| 7.1016 | 1.00009 | standard |
| 7.52291 | 1.00009 | standard |
| 7.53762 | 0.940524 | standard |
| 7.08877 | 0.955054 | standard |
| 7.09982 | 1.00009 | standard |
| 7.52469 | 1.00009 | standard |
| 7.53575 | 0.955054 | standard |
| 7.08985 | 0.962957 | standard |
| 7.09874 | 0.99915 | standard |
| 7.52578 | 1.0001 | standard |
| 7.53456 | 0.963945 | standard |
| 7.09064 | 1.00011 | standard |
| 7.09795 | 1.00011 | standard |
| 7.52647 | 0.998921 | standard |
| 7.53387 | 0.99892 | standard |
| 7.09114 | 0.998706 | standard |
| 7.09745 | 0.998707 | standard |
| 7.52706 | 1.00011 | standard |
| 7.53328 | 1.00011 | standard |
| 7.09143 | 1.00011 | standard |
| 7.09726 | 1.00011 | standard |
| 7.52726 | 1.00011 | standard |
| 7.53308 | 1.00011 | standard |
| 7.09153 | 0.998502 | standard |
| 7.09706 | 0.998502 | standard |
| 7.52746 | 1.00011 | standard |
| 7.53288 | 1.00011 | standard |
| 7.09193 | 1.00011 | standard |
| 7.09676 | 1.00011 | standard |
| 7.52775 | 1.00011 | standard |
| 7.53259 | 1.00011 | standard |
| 7.09202 | 1.00011 | standard |
| 7.09666 | 1.00011 | standard |
| 7.52785 | 1.00011 | standard |
| 7.53249 | 1.00011 | standard |
| 7.09212 | 1.0001 | standard |
| 7.09657 | 1.0001 | standard |
| 7.52795 | 1.0001 | standard |
| 7.53239 | 1.0001 | standard |
| 7.09262 | 1.0001 | standard |
| 7.09607 | 1.0001 | standard |
| 7.52844 | 1.0001 | standard |
| 7.5319 | 1.0001 | standard |