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2-Cyclopropylamino-6,7,8-trifluoro-4-oxo-4H-thiochromene-3-carboxylic acid, ethyl ester
SpectraBase Compound ID H7P6ddsWNhd
InChI InChI=1S/C15H12F3NO3S/c1-2-22-15(21)9-12(20)7-5-8(16)10(17)11(18)13(7)23-14(9)19-6-3-4-6/h5-6,19H,2-4H2,1H3
InChIKey DLDGCEBEPRXZHQ-UHFFFAOYSA-N
Mol Weight 343.32 g/mol
Molecular Formula C15H12F3NO3S
Exact Mass 343.048999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43Bh8TvNJdu
Name 2-Cyclopropylamino-6,7,8-trifluoro-4-oxo-4H-thiochromene-3-carboxylic acid, ethyl ester
Comments Structure changed after expert review
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Formula C15H12F3NO3S
InChI InChI=1S/C15H12F3NO3S/c1-2-22-15(21)9-12(20)7-5-8(16)10(17)11(18)13(7)23-14(9)19-6-3-4-6/h5-6,19H,2-4H2,1H3
InChIKey DLDGCEBEPRXZHQ-UHFFFAOYSA-N
Molecular Weight 343.320 g/mol
SMILES N(C1CC1)C=1Sc2c(F)c(F)c(cc2C(C1C(OCC)=O)=O)F
SPLASH splash10-00di-3490000000-9d46e017046417f7b042
Synonyms Ethyl 2-(cyclopropylamino)-6,7,8-trifluoro-4-oxo-4H-thiochromene-3-carboxylate 2-(cyclopropylamino)-6,7,8-trifluoro-4-oxo-1-benzothiopyran-3-carboxylic acid ethyl ester Ethyl 2-(cyclopropylamino)-6,7,8-trifluoro-4-oxothiochromene-3-carboxylate Ethyl 2-(cyclopropylamino)-6,7,8-trifluoro-4-oxo-thiochromene-3-carboxylate Ethyl 2-(cyclopropylamino)-6,7,8-tris(fluoranyl)-4-oxidanylidene-thiochromene-3-carboxylate 2-(cyclopropylamino)-6,7,8-trifluoro-4-keto-thiochromene-3-carboxylic acid ethyl ester
Wiley ID 1475632