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1,5-Dioxaspiro[5.5]undecane-2,4-dione, 3-(4-methylsulfanylbenzylidene)-
SpectraBase Compound ID GyJN8MTWAeD
InChI InChI=1S/C17H18O4S/c1-22-13-7-5-12(6-8-13)11-14-15(18)20-17(21-16(14)19)9-3-2-4-10-17/h5-8,11H,2-4,9-10H2,1H3
InChIKey PVBVTSBZGUUZKE-UHFFFAOYSA-N
Mol Weight 318.39 g/mol
Molecular Formula C17H18O4S
Exact Mass 318.09258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgIHAoY07Kc
Name 1,5-Dioxaspiro[5.5]undecane-2,4-dione, 3-(4-methylsulfanylbenzylidene)-
Alternate Name(s) 3-[4-(methylsulfanyl)benzylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione 9-[(4-methylsulfanylphenyl)methylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione 3-[[4-(methylthio)phenyl]methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione 3-[(4-methylsulfanylphenyl)methylene]-1,5-dioxaspiro[5.5]undecane-2,4-dione 3-[(4-methylsulfanylphenyl)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
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Formula C17H18O4S
InChI InChI=1S/C17H18O4S/c1-22-13-7-5-12(6-8-13)11-14-15(18)20-17(21-16(14)19)9-3-2-4-10-17/h5-8,11H,2-4,9-10H2,1H3
InChIKey PVBVTSBZGUUZKE-UHFFFAOYSA-N
Molecular Weight 318.387 g/mol
SMILES C1(C(OC2(OC1=O)CCCCC2)=O)=Cc1ccc(cc1)SC
SPLASH splash10-002o-9800000000-90e27cac1833427a7dff
Wiley ID 1438364