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2-[5-(2-isopropoxy-1-isopropoxycarbonyl-2-keto-ethylidene)-1,2,4-trithiolan-3-ylidene]malonic acid diisopropyl ester
SpectraBase Compound ID IquIXcG6F96
InChI InChI=1S/C20H28O8S3/c1-9(2)25-15(21)13(16(22)26-10(3)4)19-29-20(31-30-19)14(17(23)27-11(5)6)18(24)28-12(7)8/h9-12H,1-8H3
InChIKey QBXZCKYJCYAMOE-UHFFFAOYSA-N
Mol Weight 492.62 g/mol
Molecular Formula C20H28O8S3
Exact Mass 492.094631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DdqyjWV9TT
Name 2-[5-(2-isopropoxy-1-isopropoxycarbonyl-2-keto-ethylidene)-1,2,4-trithiolan-3-ylidene]malonic acid diisopropyl ester
Alternate Name(s) 2-[5-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,2,4-trithiolan-3-ylidene]propanedioic acid dipropan-2-yl ester diisopropyl 2-[5-(2-isopropoxy-1-isopropoxycarbonyl-2-oxo-ethylidene)-1,2,4-trithiolan-3-ylidene]propanedioate dipropan-2-yl 2-[5-[1,3-bis(oxidanylidene)-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,2,4-trithiolan-3-ylidene]propanedioate dipropan-2-yl 2-[5-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,2,4-trithiolan-3-ylidene]propanedioate
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Formula C20H28O8S3
InChI InChI=1S/C20H28O8S3/c1-9(2)25-15(21)13(16(22)26-10(3)4)19-29-20(31-30-19)14(17(23)27-11(5)6)18(24)28-12(7)8/h9-12H,1-8H3
InChIKey QBXZCKYJCYAMOE-UHFFFAOYSA-N
Molecular Weight 492.616 g/mol
SMILES C1(=C(C(OC(C)C)=O)C(OC(C)C)=O)SC(=C(C(OC(C)C)=O)C(OC(C)C)=O)SS1
SPLASH splash10-0006-5574900000-e75a0653abece2bff80f
Source of Spectrum AJ-63-3102-30
Wiley ID 1397481