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1-(2-Hexyloxy-phenyl)-5,5-dioxo-hexahydro-5.lambda.(6)-thieno[3,4-b]pyrrol-2-one
SpectraBase Compound ID 3opgYq2zCA3
InChI InChI=1S/C18H25NO4S/c1-2-3-4-7-10-23-17-9-6-5-8-15(17)19-16-13-24(21,22)12-14(16)11-18(19)20/h5-6,8-9,14,16H,2-4,7,10-13H2,1H3
InChIKey XQLJLRCGNWBVEF-UHFFFAOYSA-N
Mol Weight 351.46 g/mol
Molecular Formula C18H25NO4S
Exact Mass 351.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7iVIw3W5d8C
Name 1-(2-Hexyloxy-phenyl)-5,5-dioxo-hexahydro-5.lambda.(6)-thieno[3,4-b]pyrrol-2-one
Alternate Name(s) 1-(2-hexoxyphenyl)-5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydro-3H-thieno[3,4-b]pyrrol-2-one 1-(2-hexoxyphenyl)-5,5-diketo-3a,4,6,6a-tetrahydro-3H-thieno[3,4-b]pyrrol-2-one 1-(2-hexoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydro-3H-thieno[3,4-b]pyrrol-2-one
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Formula C18H25NO4S
InChI InChI=1S/C18H25NO4S/c1-2-3-4-7-10-23-17-9-6-5-8-15(17)19-16-13-24(21,22)12-14(16)11-18(19)20/h5-6,8-9,14,16H,2-4,7,10-13H2,1H3
InChIKey XQLJLRCGNWBVEF-UHFFFAOYSA-N
Molecular Weight 351.461 g/mol
SMILES c1ccc(N2C3CS(CC3CC2=O)(=O)=O)c(OCCCCCC)c1
SPLASH splash10-000l-4920000000-ce2bd9e5b3927be86203
Wiley ID 1437214