![1-{a-[mercapto(3,5-xylididno)methylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt](/api/spectrum/BDhSgIdNmV9/structure.png?h=300&w=458 "1-{a-[mercapto(3,5-xylididno)methylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt")
| SpectraBase Compound ID | HW0XTk4rQDY |
|---|---|
| InChI | InChI=1S/C22H19N3O3S/c1-15-12-16(2)14-18(13-15)23-22(29)20(24-10-4-3-5-11-24)21(26)17-6-8-19(9-7-17)25(27)28/h3-14H,1-2H3,(H-,23,26,29) |
| InChIKey | BZODMANLYQJJJM-UHFFFAOYSA-N |
| Mol Weight | 405.47 g/mol |
| Molecular Formula | C22H19N3O3S |
| Exact Mass | 405.114713 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BDhSgIdNmV9 |
|---|---|
| Name | 1-{a-[mercapto(3,5-xylididno)methylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H19N3O3S |
| InChI | InChI=1S/C22H19N3O3S/c1-15-12-16(2)14-18(13-15)23-22(29)20(24-10-4-3-5-11-24)21(26)17-6-8-19(9-7-17)25(27)28/h3-14H,1-2H3,(H-,23,26,29) |
| InChIKey | BZODMANLYQJJJM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 30987M |
| Solvent | Polysol |