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3'-nitro-4'-[(2-pyridyl)thio]acetophenone

View entire compound with spectra: 2 NMR, and 1 MS (GC)

3'-nitro-4'-[(2-pyridyl)thio]acetophenone
SpectraBase Compound ID LYejATrZeMr
InChI InChI=1S/C13H10N2O3S/c1-9(16)10-5-6-12(11(8-10)15(17)18)19-13-4-2-3-7-14-13/h2-8H,1H3
InChIKey FCOYEURPIOTRFX-UHFFFAOYSA-N
Mol Weight 274.29 g/mol
Molecular Formula C13H10N2O3S
Exact Mass 274.041213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kghj4YWThqx
Name 1-[3-Nitro-4-(pyridin-2-ylsulfanyl)-phenyl]-ethanone
Alternate Name(s) 1-[3-Nitro-4-(2-pyridinylsulfanyl)phenyl]ethanone 1-[3-nitro-4-(2-pyridinylthio)phenyl]ethanone 1-[3-nitro-4-(2-pyridylsulfanyl)phenyl]ethanone 1-[3-nitro-4-(2-pyridylthio)phenyl]ethanone 1-(3-nitro-4-pyridin-2-ylsulfanylphenyl)ethanone
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Formula C13H10N2O3S
InChI InChI=1S/C13H10N2O3S/c1-9(16)10-5-6-12(11(8-10)15(17)18)19-13-4-2-3-7-14-13/h2-8H,1H3
InChIKey FCOYEURPIOTRFX-UHFFFAOYSA-N
Molecular Weight 274.294 g/mol
SMILES c1(N(=O)=O)c(Sc2ncccc2)ccc(c1)C(=O)C
SPLASH splash10-004i-9660000000-b49883ffa12bacecdcff
Wiley ID 1461060