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2-ETHOXYCARBONYL-5-METHOXYCARBONYL-4-(4-METHOXYCARBONYL-PHENYL)-6-METHYL-4,7-DIHYDRO-THIENO-[2,3-B]-PYRIDINE
SpectraBase Compound ID 4SSEDOt3MzJ
InChI InChI=1S/C21H21NO6S/c1-5-28-20(24)15-10-14-17(12-6-8-13(9-7-12)19(23)26-3)16(21(25)27-4)11(2)22-18(14)29-15/h6-10,17,22H,5H2,1-4H3
InChIKey WZVQZOZQSLLWHA-UHFFFAOYSA-N
Mol Weight 415.46 g/mol
Molecular Formula C21H21NO6S
Exact Mass 415.108959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLy8f6kVSIM
Name 2-O-ethyl 5-O-methyl 4-(4-methoxycarbonylphenyl)-6-methyl-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate
Alternate Name(s) 4-(4-carbomethoxyphenyl)-6-methyl-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylic acid O2-ethyl ester O5-methyl ester 4-(4-Methoxycarbonylphenyl)-6-methyl-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylic acid O2-ethyl ester O5-methyl ester O2-ethyl O5-methyl 4-(4-methoxycarbonylphenyl)-6-methyl-4,7-dihydrothieno[2,3-b]pyridine-2,5-dicarboxylate
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Formula C21H21NO6S
InChI InChI=1S/C21H21NO6S/c1-5-28-20(24)15-10-14-17(12-6-8-13(9-7-12)19(23)26-3)16(21(25)27-4)11(2)22-18(14)29-15/h6-10,17,22H,5H2,1-4H3
InChIKey WZVQZOZQSLLWHA-UHFFFAOYSA-N
Molecular Weight 415.460 g/mol
SMILES N1c2c(C(C(=C1C)C(=O)OC)c1ccc(C(=O)OC)cc1)cc(s2)C(=O)OCC
SPLASH splash10-0kai-0094200000-ac9a5ba67568a644fb12
Source of Spectrum Y-34-934-10
Wiley ID 1375935