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10-Oxo-3-[(ethoxycarbonyl)methylthio]-10[1H]-[1]benzothiopyrano[3,2-c]pyridine-4-carbonitrile
SpectraBase Compound ID 8uAIozKayX0
InChI InChI=1S/C17H12N2O3S2/c1-2-22-14(20)9-23-17-11(7-18)16-12(8-19-17)15(21)10-5-3-4-6-13(10)24-16/h3-6,8H,2,9H2,1H3
InChIKey OQTYMOGKTCJDFZ-UHFFFAOYSA-N
Mol Weight 356.41 g/mol
Molecular Formula C17H12N2O3S2
Exact Mass 356.028935 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8eG2XKYgWC8
Name 10-Oxo-3-[(ethoxycarbonyl)methylthio]-10[1H]-[1]benzothiopyrano[3,2-c]pyridine-4-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C17H12N2O3S2
InChI InChI=1S/C17H12N2O3S2/c1-2-22-14(20)9-23-17-11(7-18)16-12(8-19-17)15(21)10-5-3-4-6-13(10)24-16/h3-6,8H,2,9H2,1H3
InChIKey OQTYMOGKTCJDFZ-UHFFFAOYSA-N
Molecular Weight 356.414 g/mol
SMILES c12c(C(=O)c3c(S2)cccc3)cnc(c1C#N)SCC(=O)OCC
SPLASH splash10-0a4i-9001000000-3b877f9ad070cea550d6
Source of Spectrum U-1993-1004-10
Synonyms ethyl[(4-cyano-10-oxo-10H-[1]benzothiopyrano[3,2-c]pyridin-3-yl)sulfanyl]acetate
Wiley ID 765425