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2-[Fluoro-(1H-indol-3-ylsulfanyl)-methylene]-malonic acid dimethyl ester
SpectraBase Compound ID 2oR56sYZR9u
InChI InChI=1S/C14H12FNO4S/c1-19-13(17)11(14(18)20-2)12(15)21-10-7-16-9-6-4-3-5-8(9)10/h3-7,16H,1-2H3
InChIKey XKVZJRBUIUBVKX-UHFFFAOYSA-N
Mol Weight 309.31 g/mol
Molecular Formula C14H12FNO4S
Exact Mass 309.047107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YAoHZ8y7j4
Name 2-[Fluoro-(1H-indol-3-ylsulfanyl)-methylene]-malonic acid dimethyl ester
Alternate Name(s) 2-[fluoro-(1H-indol-3-ylthio)methylene]malonic acid dimethyl ester 2-[fluoro-(1H-indol-3-ylthio)methylidene]propanedioic acid dimethyl ester Dimethyl 2-[fluoranyl(1H-indol-3-ylsulfanyl)methylidene]propanedioate Dimethyl 2-[fluoro(1H-indol-3-ylsulfanyl)methylene]malonate Dimethyl 2-[fluoro(1H-indol-3-ylsulfanyl)methylene]propanedioate Dimethyl 2-[fluoro(1H-indol-3-ylsulfanyl)methylidene]propanedioate
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Formula C14H12FNO4S
InChI InChI=1S/C14H12FNO4S/c1-19-13(17)11(14(18)20-2)12(15)21-10-7-16-9-6-4-3-5-8(9)10/h3-7,16H,1-2H3
InChIKey XKVZJRBUIUBVKX-UHFFFAOYSA-N
Molecular Weight 309.311 g/mol
SMILES [nH]1c2c(c(c1)SC(=C(C(OC)=O)C(OC)=O)F)cccc2
SPLASH splash10-052b-4961000000-51d2d9f23023d9d8aa53
Wiley ID 1464354