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Dimethyl 5-(Methylthio)-4-oxo-7,7-dimethyl-7,8-dihydro-benzo[b]thiopyran-2,3-dicarboxylate
SpectraBase Compound ID 6jxx7DO9UBk
InChI InChI=1S/C16H18O5S2/c1-16(2)6-8(22-5)10-9(7-16)23-13(15(19)21-4)11(12(10)17)14(18)20-3/h6H,7H2,1-5H3
InChIKey GUXZPTSDQZCJKQ-UHFFFAOYSA-N
Mol Weight 354.44 g/mol
Molecular Formula C16H18O5S2
Exact Mass 354.059566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMRhWwUptZH
Name Dimethyl 5-(Methylthio)-4-oxo-7,7-dimethyl-7,8-dihydro-benzo[b]thiopyran-2,3-dicarboxylate
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Formula C16H18O5S2
InChI InChI=1S/C16H18O5S2/c1-16(2)6-8(22-5)10-9(7-16)23-13(15(19)21-4)11(12(10)17)14(18)20-3/h6H,7H2,1-5H3
InChIKey GUXZPTSDQZCJKQ-UHFFFAOYSA-N
Molecular Weight 354.435 g/mol
SMILES C1(=C(SC2=C(C1=O)C(=CC(C)(C)C2)SC)C(=O)OC)C(=O)OC
SPLASH splash10-0a4r-7119000000-b28de3d5d49e6b0a12b9
Source of Spectrum J-56-1906-8
Synonyms Dimethyl 7,7-dimethyl-5-(methylsulfanyl)-4-oxo-7,8-dihydro-4H-1-benzothiopyran-2,3-dicarboxylate
Wiley ID 1344320