![4'-[(o-aminophenyl)thio]-3'-nitroacetophenone](/api/spectrum/8s6NE6Dx8JZ/structure.png?h=300&w=458 "4'-[(o-aminophenyl)thio]-3'-nitroacetophenone")
| SpectraBase Compound ID | H8B2WA13by |
|---|---|
| InChI | InChI=1S/C14H12N2O3S/c1-9(17)10-6-7-14(12(8-10)16(18)19)20-13-5-3-2-4-11(13)15/h2-8H,15H2,1H3 |
| InChIKey | KQQWGWNTDJNMEF-UHFFFAOYSA-N |
| Mol Weight | 288.32 g/mol |
| Molecular Formula | C14H12N2O3S |
| Exact Mass | 288.056863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8s6NE6Dx8JZ |
|---|---|
| Name | 4'-[(o-aminophenyl)thio]-3'-nitroacetophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.056863425 u |
| Formula | C14H12N2O3S |
| InChI | InChI=1S/C14H12N2O3S/c1-9(17)10-6-7-14(12(8-10)16(18)19)20-13-5-3-2-4-11(13)15/h2-8H,15H2,1H3 |
| InChIKey | KQQWGWNTDJNMEF-UHFFFAOYSA-N |
| SMILES | N(=O)(=O)C=1C(SC=2C=CC=CC2N)=CC=C(C1)C(C)=O |