![1-methyl-2-[3-methyl-6-(methylthio)-3H-purin-8-yl]pyridinium iodide](/api/spectrum/7I2vc7fwiNq/structure.png?h=300&w=458 "1-methyl-2-[3-methyl-6-(methylthio)-3H-purin-8-yl]pyridinium iodide")
| SpectraBase Compound ID | 6mlN6vwCJs0 |
|---|---|
| InChI | InChI=1S/C13H14N5S.HI/c1-17-7-5-4-6-9(17)11-15-10-12(16-11)18(2)8-14-13(10)19-3;/h4-8H,1-3H3;1H/q+1;/p-1 |
| InChIKey | IAMYORKOKDQERN-UHFFFAOYSA-M |
| Mol Weight | 399.25447 g/mol |
| Molecular Formula | C13H14IN5S |
| Exact Mass | 399.001462 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7I2vc7fwiNq |
|---|---|
| Name | 1-methyl-2-[3-methyl-6-(methylthio)-3H-purin-8-yl]pyridinium iodide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14IN5S |
| InChI | InChI=1S/C13H14N5S.HI/c1-17-7-5-4-6-9(17)11-15-10-12(16-11)18(2)8-14-13(10)19-3;/h4-8H,1-3H3;1H/q+1;/p-1 |
| InChIKey | IAMYORKOKDQERN-UHFFFAOYSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 43626M |
| Solvent | Polysol-d |