![1-{3-{[(p-chlorophenyl)thio]methyl}-4-methoxyphenacyl}pyridinium iodide](/api/spectrum/5NuAgEe4cip/structure.png?h=300&w=458 "1-{3-{[(p-chlorophenyl)thio]methyl}-4-methoxyphenacyl}pyridinium iodide")
| SpectraBase Compound ID | JbsGJDrV6Xz |
|---|---|
| InChI | InChI=1S/C21H19ClNO2S.HI/c1-25-21-10-5-16(20(24)14-23-11-3-2-4-12-23)13-17(21)15-26-19-8-6-18(22)7-9-19;/h2-13H,14-15H2,1H3;1H/q+1;/p-1 |
| InChIKey | CCFWHRUIUGLLFM-UHFFFAOYSA-M |
| Mol Weight | 511.81 g/mol |
| Molecular Formula | C21H19ClINO2S |
| Exact Mass | 510.986973 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5NuAgEe4cip |
|---|---|
| Name | 1-{3-{[(p-chlorophenyl)thio]methyl}-4-methoxyphenacyl}pyridinium iodide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H19ClNO2S |
| InChI | InChI=1S/C21H19ClNO2S.HI/c1-25-21-10-5-16(20(24)14-23-11-3-2-4-12-23)13-17(21)15-26-19-8-6-18(22)7-9-19;/h2-13H,14-15H2,1H3;1H/q+1;/p-1 |
| InChIKey | CCFWHRUIUGLLFM-UHFFFAOYSA-M |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 24930M |
| Solvent | DMSO-d6 |