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3-ACETAMIDO-4-NITRO-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER
SpectraBase Compound ID 2yICodSzfRq
InChI InChI=1S/C8H8N2O5S/c1-4(11)9-6-5(10(13)14)3-16-7(6)8(12)15-2/h3H,1-2H3,(H,9,11)
InChIKey MOABQEABDWBTFK-UHFFFAOYSA-N
Mol Weight 244.22 g/mol
Molecular Formula C8H8N2O5S
Exact Mass 244.015393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmXXzsI6fPr
Name Methyl 3-(acetylamino)-4-nitrothiophene-2-carboxylate
Alternate Name(s) 3-Acetamido-4-nitro-2-thiophenecarboxylic acid methyl ester 3-Acetamido-4-nitro-thiophene-2-carboxylic acid methyl ester Methyl 3-acetamido-4-nitro-thiophene-2-carboxylate
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Formula C8H8N2O5S
InChI InChI=1S/C8H8N2O5S/c1-4(11)9-6-5(10(13)14)3-16-7(6)8(12)15-2/h3H,1-2H3,(H,9,11)
InChIKey MOABQEABDWBTFK-UHFFFAOYSA-N
Molecular Weight 244.221 g/mol
SMILES N(c1c(N(=O)=O)csc1C(=O)OC)C(=O)C
SPLASH splash10-0udi-9380000000-d4ceceef27f221f732d2
Source of Spectrum H-81-30-3
Wiley ID 1246432