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2-Acetyl-3-(p-nitrophenyl)thiophene
SpectraBase Compound ID 9OmtN7xhmTA
InChI InChI=1S/C12H9NO3S/c1-8(14)12-11(6-7-17-12)9-2-4-10(5-3-9)13(15)16/h2-7H,1H3
InChIKey VXFPOGYHODBGEY-UHFFFAOYSA-N
Mol Weight 247.27 g/mol
Molecular Formula C12H9NO3S
Exact Mass 247.030314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IJ3AOEukmjK
Name 2-Acetyl-3-(p-nitrophenyl)thiophene
Alternate Name(s) 1-[3-(4-nitrophenyl)-2-thienyl]ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C12H9NO3S
InChI InChI=1S/C12H9NO3S/c1-8(14)12-11(6-7-17-12)9-2-4-10(5-3-9)13(15)16/h2-7H,1H3
InChIKey VXFPOGYHODBGEY-UHFFFAOYSA-N
Molecular Weight 247.268 g/mol
SMILES c1(N(=O)=O)ccc(-c2c(scc2)C(=O)C)cc1
SPLASH splash10-001j-0090000000-700b7d7f7f181b3ddd5a
Source of Spectrum SK-20-2543-4
Wiley ID 851526