![1-{a-[(o-chloroanilino)mercaptomethylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt](/api/spectrum/9dbLerfkYlB/structure.png?h=300&w=458 "1-{a-[(o-chloroanilino)mercaptomethylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt")
| SpectraBase Compound ID | 491TmDXW8vM |
|---|---|
| InChI | InChI=1S/C20H14ClN3O3S/c21-16-6-2-3-7-17(16)22-20(28)18(23-12-4-1-5-13-23)19(25)14-8-10-15(11-9-14)24(26)27/h1-13H,(H-,22,25,28) |
| InChIKey | HJMWXTBATZVXRR-UHFFFAOYSA-N |
| Mol Weight | 411.86 g/mol |
| Molecular Formula | C20H14ClN3O3S |
| Exact Mass | 411.04444 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9dbLerfkYlB |
|---|---|
| Name | 1-{a-[(o-chloroanilino)mercaptomethylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H14ClN3O3S |
| InChI | InChI=1S/C20H14ClN3O3S/c21-16-6-2-3-7-17(16)22-20(28)18(23-12-4-1-5-13-23)19(25)14-8-10-15(11-9-14)24(26)27/h1-13H,(H-,22,25,28) |
| InChIKey | HJMWXTBATZVXRR-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 27839M |
| Solvent | Polysol |