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1-Benzyl-2,6,6-triketo-3-methoxy-5,7-dihydrothieno[3,4-b]pyridine-7-carboxylic acid methyl ester
SpectraBase Compound ID KbMPJ9lvTkN
InChI InChI=1S/C17H17NO6S/c1-23-13-8-12-10-25(21,22)15(17(20)24-2)14(12)18(16(13)19)9-11-6-4-3-5-7-11/h3-8,15H,9-10H2,1-2H3
InChIKey BEMKNAPVMRFBFB-UHFFFAOYSA-N
Mol Weight 363.38 g/mol
Molecular Formula C17H17NO6S
Exact Mass 363.077658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DT5qq32syQ1
Name 1-Benzyl-2,6,6-triketo-3-methoxy-5,7-dihydrothieno[3,4-b]pyridine-7-carboxylic acid methyl ester
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Formula C17H17NO6S
InChI InChI=1S/C17H17NO6S/c1-23-13-8-12-10-25(21,22)15(17(20)24-2)14(12)18(16(13)19)9-11-6-4-3-5-7-11/h3-8,15H,9-10H2,1-2H3
InChIKey BEMKNAPVMRFBFB-UHFFFAOYSA-N
Molecular Weight 363.384 g/mol
SMILES C12=C(C=C(C(N2Cc2ccccc2)=O)OC)CS(C1C(=O)OC)(=O)=O
SPLASH splash10-0006-9022000000-9871cb89ac01d991baa9
Source of Spectrum KC-60-438-37
Synonyms 3-Methoxy-2,6,6-trioxo-1-(phenylmethyl)-5,7-dihydrothieno[3,4-b]pyridine-7-carboxylic acid methyl ester Methyl 1-benzyl-3-methoxy-2,6,6-trioxo-5,7-dihydrothieno[3,4-b]pyridine-7-carboxylate Methyl 3-methoxy-2,6,6-tris(oxidanylidene)-1-(phenylmethyl)-5,7-dihydrothieno[3,4-b]pyridine-7-carboxylate
Wiley ID 1583033