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Ethyl-4-benzoyl-3-methyl-5-(phenylamino)thiophene-2-carboxylate
SpectraBase Compound ID 1AGGrwmbeLx
InChI InChI=1S/C21H19NO3S/c1-3-25-21(24)19-14(2)17(18(23)15-10-6-4-7-11-15)20(26-19)22-16-12-8-5-9-13-16/h4-13,22H,3H2,1-2H3
InChIKey ZRZFHFGDUPEMMC-UHFFFAOYSA-N
Mol Weight 365.45 g/mol
Molecular Formula C21H19NO3S
Exact Mass 365.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cg8TIi4ytsu
Name Ethyl-4-benzoyl-3-methyl-5-(phenylamino)thiophene-2-carboxylate
Alternate Name(s) 5-Anilino-4-benzoyl-3-methyl-2-thiophenecarboxylic acid ethyl ester Ethyl 5-anilino-4-benzoyl-3-methylthiophene-2-carboxylate Ethyl 5-anilino-4-benzoyl-3-methyl-thiophene-2-carboxylate Ethyl 3-methyl-5-phenylazanyl-4-(phenylcarbonyl)thiophene-2-carboxylate
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Formula C21H19NO3S
InChI InChI=1S/C21H19NO3S/c1-3-25-21(24)19-14(2)17(18(23)15-10-6-4-7-11-15)20(26-19)22-16-12-8-5-9-13-16/h4-13,22H,3H2,1-2H3
InChIKey ZRZFHFGDUPEMMC-UHFFFAOYSA-N
Molecular Weight 365.447 g/mol
SMILES N(c1ccccc1)c1c(c(c(s1)C(=O)OCC)C)C(c1ccccc1)=O
SPLASH splash10-014i-1119000000-c350a73e3a111740f401
Source of Spectrum F2-44-1255-15
Wiley ID 1716267