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Ethyl 3-(acetylamino)-7-chloro-6-cyano-4,5-dihydro-1-benzothiophene-2-carboxylate
SpectraBase Compound ID EcwGsVRz1hi
InChI InChI=1S/C14H13ClN2O3S/c1-3-20-14(19)13-11(17-7(2)18)9-5-4-8(6-16)10(15)12(9)21-13/h3-5H2,1-2H3,(H,17,18)
InChIKey JHQUMPGASIQTJY-UHFFFAOYSA-N
Mol Weight 324.78 g/mol
Molecular Formula C14H13ClN2O3S
Exact Mass 324.033541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YKenKoRhrd
Name Ethyl 3-(acetylamino)-7-chloro-6-cyano-4,5-dihydro-1-benzothiophene-2-carboxylate
Alternate Name(s) 3-Acetamido-7-chloro-6-cyano-4,5-dihydro-1-benzothiophene-2-carboxylic acid ethyl ester 3-Acetamido-7-chloro-6-cyano-4,5-dihydrobenzothiophene-2-carboxylic acid ethyl ester Benzothiophene-2-carboxylic acid, 4,5-dihydro-3-acetamido-7-chloro-6-cyano-, ethyl ester Ethyl 3-acetamido-7-chloranyl-6-cyano-4,5-dihydro-1-benzothiophene-2-carboxylate Ethyl 3-acetamido-7-chloro-6-cyano-4,5-dihydro-1-benzothiophene-2-carboxylate Ethyl 3-acetamido-7-chloro-6-cyano-4,5-dihydrobenzothiophene-2-carboxylate
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Formula C14H13ClN2O3S
InChI InChI=1S/C14H13ClN2O3S/c1-3-20-14(19)13-11(17-7(2)18)9-5-4-8(6-16)10(15)12(9)21-13/h3-5H2,1-2H3,(H,17,18)
InChIKey JHQUMPGASIQTJY-UHFFFAOYSA-N
Molecular Weight 324.782 g/mol
SMILES N(c1c(sc2C(=C(C#N)CCc12)Cl)C(=O)OCC)C(=O)C
SPLASH splash10-0006-9110000000-ebe10d4c2820adb354f0
Source of Spectrum AD-0-2532-0
Wiley ID 1419752