![Pyridine, 2-[3-(4-nitrophenoxy)propylthio]-](/api/spectrum/JUXqkrHqbd3/structure.png?h=300&w=458 "Pyridine, 2-[3-(4-nitrophenoxy)propylthio]-")
| SpectraBase Compound ID | H3LiZaZIdp0 |
|---|---|
| InChI | InChI=1S/C14H14N2O3S/c17-16(18)12-5-7-13(8-6-12)19-10-3-11-20-14-4-1-2-9-15-14/h1-2,4-9H,3,10-11H2 |
| InChIKey | VKIFSJKUFQNIIX-UHFFFAOYSA-N |
| Mol Weight | 290.34 g/mol |
| Molecular Formula | C14H14N2O3S |
| Exact Mass | 290.072513 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JUXqkrHqbd3 |
|---|---|
| Name | Pyridine, 2-[3-(4-nitrophenoxy)propylthio]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.072513490 u |
| Formula | C14H14N2O3S |
| InChI | InChI=1S/C14H14N2O3S/c17-16(18)12-5-7-13(8-6-12)19-10-3-11-20-14-4-1-2-9-15-14/h1-2,4-9H,3,10-11H2 |
| InChIKey | VKIFSJKUFQNIIX-UHFFFAOYSA-N |
| Molecular Weight | 290.337 g/mol |
| SMILES | C1=CC=NC(=C1)SCCCOC1=CC=C(N(=O)=O)C=C1 |