![5-nitro-2-[(2-pyrimidinyl)thio]nicotinic acid, hydrate](/api/spectrum/Hbp6OEZwUxk/structure.png?h=300&w=458 "5-nitro-2-[(2-pyrimidinyl)thio]nicotinic acid, hydrate")
| SpectraBase Compound ID | DhDmPstlQ4q |
|---|---|
| InChI | InChI=1S/C10H6N4O4S.H2O/c15-9(16)7-4-6(14(17)18)5-13-8(7)19-10-11-2-1-3-12-10;/h1-5H,(H,15,16);1H2 |
| InChIKey | ZGNKOMJQPRCWKB-UHFFFAOYSA-N |
| Mol Weight | 296.257 g/mol |
| Molecular Formula | C10H8N4O5S |
| Exact Mass | 296.021541 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hbp6OEZwUxk |
|---|---|
| Name | 5-nitro-2-[(2-pyrimidinyl)thio]nicotinic acid, hydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H8N4O5S |
| InChI | InChI=1S/C10H6N4O4S.H2O/c15-9(16)7-4-6(14(17)18)5-13-8(7)19-10-11-2-1-3-12-10;/h1-5H,(H,15,16);1H2 |
| InChIKey | ZGNKOMJQPRCWKB-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 35259M |
| Solvent | Polysol |