![4-[(2,4-Dinitrophenyl)thio]phenol](/api/spectrum/7VO4k5Qb28s/structure.png?h=300&w=458 "4-[(2,4-Dinitrophenyl)thio]phenol")
| SpectraBase Compound ID | D8kpwWcu66A |
|---|---|
| InChI | InChI=1S/C12H8N2O5S/c15-9-2-4-10(5-3-9)20-12-6-1-8(13(16)17)7-11(12)14(18)19/h1-7,15H |
| InChIKey | LRQBAVHIEGPNHC-UHFFFAOYSA-N |
| Mol Weight | 292.27 g/mol |
| Molecular Formula | C12H8N2O5S |
| Exact Mass | 292.015393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7VO4k5Qb28s |
|---|---|
| Name | 4-[(2,4-Dinitrophenyl)thio]phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.015392535 u |
| Formula | C12H8N2O5S |
| InChI | InChI=1S/C12H8N2O5S/c15-9-2-4-10(5-3-9)20-12-6-1-8(13(16)17)7-11(12)14(18)19/h1-7,15H |
| InChIKey | LRQBAVHIEGPNHC-UHFFFAOYSA-N |
| Molecular Weight | 292.265 g/mol |
| SMILES | C1(N(=O)=O)=CC(N(=O)=O)=CC=C1SC=1C=CC(=CC1)O |