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5-Nitro-3-(2,3,3,3-tetrafluoro-2-methoxy-propionylamino)-benzo[b]thiophene-2-carboxylic acid methyl ester
SpectraBase Compound ID BuibSuMWTUQ
InChI InChI=1S/C14H10F4N2O6S/c1-25-11(21)10-9(19-12(22)13(15,26-2)14(16,17)18)7-5-6(20(23)24)3-4-8(7)27-10/h3-5H,1-2H3,(H,19,22)
InChIKey DGEOAACOOJUAPU-UHFFFAOYSA-N
Mol Weight 410.3 g/mol
Molecular Formula C14H10F4N2O6S
Exact Mass 410.01957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FMXFABUhXjb
Name 5-Nitro-3-(2,3,3,3-tetrafluoro-2-methoxy-propionylamino)-benzo[b]thiophene-2-carboxylic acid methyl ester
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Formula C14H10F4N2O6S
InChI InChI=1S/C14H10F4N2O6S/c1-25-11(21)10-9(19-12(22)13(15,26-2)14(16,17)18)7-5-6(20(23)24)3-4-8(7)27-10/h3-5H,1-2H3,(H,19,22)
InChIKey DGEOAACOOJUAPU-UHFFFAOYSA-N
Molecular Weight 410.296 g/mol
SMILES N(C(C(C(F)(F)F)(F)OC)=O)c1c(sc2ccc(N(=O)=O)cc12)C(=O)OC
SPLASH splash10-0002-5590100000-396b9408ec24ab4a8c0c
Synonyms 5-Nitro-3-[(2,3,3,3-tetrafluoro-2-methoxy-1-oxopropyl)amino]-1-benzothiophene-2-carboxylic acid methyl ester 5-Nitro-3-[(2,3,3,3-tetrafluoro-2-methoxy-propanoyl)amino]benzothiophene-2-carboxylic acid methyl ester Methyl 5-nitro-3-[(2,3,3,3-tetrafluoro-2-methoxy-propanoyl)amino]benzothiophene-2-carboxylate Methyl 5-nitro-3-[(2,3,3,3-tetrafluoro-2-methoxypropanoyl)amino]-1-benzothiophene-2-carboxylate Methyl 5-nitro-3-[[2,3,3,3-tetrakis(fluoranyl)-2-methoxy-propanoyl]amino]-1-benzothiophene-2-carboxylate
Wiley ID 1459523