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Thiophene-2-carboxylic acid, 5-bicyclo[2.2.1]heptanoylamino-4-cyano-3-methyl-, ethyl ester
SpectraBase Compound ID 8K9P6ZtRXo3
InChI InChI=1S/C17H20N2O3S/c1-3-22-17(21)14-9(2)13(8-18)16(23-14)19-15(20)12-7-10-4-5-11(12)6-10/h10-12H,3-7H2,1-2H3,(H,19,20)
InChIKey IXHJDQFQQLWVEX-UHFFFAOYSA-N
Mol Weight 332.42 g/mol
Molecular Formula C17H20N2O3S
Exact Mass 332.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13Q8Wcl2tym
Name Thiophene-2-carboxylic acid, 5-bicyclo[2.2.1]heptanoylamino-4-cyano-3-methyl-, ethyl ester
Alternate Name(s) 4-cyano-3-methyl-5-(norbornane-2-carbonylamino)thiophene-2-carboxylic acid ethyl ester 5-[[3-bicyclo[2.2.1]heptanyl(oxo)methyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester Ethyl 4-cyano-3-methyl-5-(norbornane-2-carbonylamino)thiophene-2-carboxylate Ethyl 5-(3-bicyclo[2.2.1]heptanylcarbonylamino)-4-cyano-3-methyl-thiophene-2-carboxylate Ethyl 5-(bicyclo[2.2.1]heptane-3-carbonylamino)-4-cyano-3-methylthiophene-2-carboxylate Ethyl 5-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-4-cyano-3-methyl-2-thiophenecarboxylate
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Formula C17H20N2O3S
InChI InChI=1S/C17H20N2O3S/c1-3-22-17(21)14-9(2)13(8-18)16(23-14)19-15(20)12-7-10-4-5-11(12)6-10/h10-12H,3-7H2,1-2H3,(H,19,20)
InChIKey IXHJDQFQQLWVEX-UHFFFAOYSA-N
Molecular Weight 332.418 g/mol
SMILES N(C(=O)C1C2CCC(C1)C2)c1sc(c(c1C#N)C)C(OCC)=O
SPLASH splash10-0002-9210000000-bd199e9f6277e8ecd75b
Source of Spectrum AD-0-2532-0
Wiley ID 1431259