![1-{α-[(m-anisidino)mercaptomethylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt](/api/spectrum/56fSpT90jCC/structure.png?h=300&w=458 "1-{α-[(m-anisidino)mercaptomethylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt")
| SpectraBase Compound ID | 6w9kkBzOhcv |
|---|---|
| InChI | InChI=1S/C21H17N3O4S/c1-28-18-7-5-6-16(14-18)22-21(29)19(23-12-3-2-4-13-23)20(25)15-8-10-17(11-9-15)24(26)27/h2-14H,1H3,(H-,22,25,29) |
| InChIKey | GIFJVYIVEXRHBI-UHFFFAOYSA-N |
| Mol Weight | 407.44 g/mol |
| Molecular Formula | C21H17N3O4S |
| Exact Mass | 407.093977 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 56fSpT90jCC |
|---|---|
| Name | 1-{α-[(m-anisidino)mercaptomethylene]-p-nitrophenacyl}pyridinium hydroxide, inner salt |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H17N3O4S |
| InChI | InChI=1S/C21H17N3O4S/c1-28-18-7-5-6-16(14-18)22-21(29)19(23-12-3-2-4-13-23)20(25)15-8-10-17(11-9-15)24(26)27/h2-14H,1H3,(H-,22,25,29) |
| InChIKey | GIFJVYIVEXRHBI-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 22031M |
| Solvent | DMSO-d6 |