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2-(ethylthio)-3-(4-nitroanilino)-2H-furan-5-one
SpectraBase Compound ID 9MK0hKJUmy5
InChI InChI=1S/C12H12N2O4S/c1-2-19-12-10(7-11(15)18-12)13-8-3-5-9(6-4-8)14(16)17/h3-7,12-13H,2H2,1H3
InChIKey OUWUUNTWOOSDRA-UHFFFAOYSA-N
Mol Weight 280.3 g/mol
Molecular Formula C12H12N2O4S
Exact Mass 280.051778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtvhgCJIYvv
Name 2-(ethylthio)-3-(4-nitroanilino)-2H-furan-5-one
Alternate Name(s) 2-ethylsulfanyl-3-(4-nitroanilino)-2H-furan-5-one 2-ethylsulfanyl-3-[(4-nitrophenyl)amino]-2H-furan-5-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H12N2O4S
InChI InChI=1S/C12H12N2O4S/c1-2-19-12-10(7-11(15)18-12)13-8-3-5-9(6-4-8)14(16)17/h3-7,12-13H,2H2,1H3
InChIKey OUWUUNTWOOSDRA-UHFFFAOYSA-N
Molecular Weight 280.298 g/mol
SMILES N(C1=CC(=O)OC1SCC)c1ccc(N(=O)=O)cc1
SPLASH splash10-014i-0090000000-71de15533b06883df64f
Source of Spectrum H1-52-248-17
Wiley ID 817600