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1,4-Dithiaspiro[4.5]decan-8-one-7,9-diacetic acid, diethyl ester
SpectraBase Compound ID QLsp3pHtx
InChI InChI=1S/C16H24O5S2/c1-3-20-13(17)7-11-9-16(22-5-6-23-16)10-12(15(11)19)8-14(18)21-4-2/h11-12H,3-10H2,1-2H3
InChIKey GXJIQFBFBOFXJU-UHFFFAOYSA-N
Mol Weight 360.48 g/mol
Molecular Formula C16H24O5S2
Exact Mass 360.106516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 185WprVjtiV
Name 1,4-Dithiaspiro[4.5]decan-8-one-7,9-diacetic acid, diethyl ester
Alternate Name(s) 2-[7-(2-ethoxy-2-oxoethyl)-8-oxo-1,4-dithiaspiro[4.5]decan-9-yl]acetic acid ethyl ester Ethyl 2-[7-(2-ethoxy-2-oxoethyl)-8-oxo-1,4-dithiaspiro[4.5]decan-9-yl]acetate Ethyl 2-[7-(2-ethoxy-2-oxo-ethyl)-8-oxo-1,4-dithiaspiro[4.5]decan-9-yl]acetate Ethyl 2-[7-(2-ethoxy-2-oxidanylidene-ethyl)-8-oxidanylidene-1,4-dithiaspiro[4.5]decan-9-yl]ethanoate
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Formula C16H24O5S2
InChI InChI=1S/C16H24O5S2/c1-3-20-13(17)7-11-9-16(22-5-6-23-16)10-12(15(11)19)8-14(18)21-4-2/h11-12H,3-10H2,1-2H3
InChIKey GXJIQFBFBOFXJU-UHFFFAOYSA-N
Molecular Weight 360.483 g/mol
SMILES C12(SCCS2)CC(CC(=O)OCC)C(=O)C(C1)CC(=O)OCC
SPLASH splash10-03xr-5963000000-c95c69cbf79784547e23
Wiley ID 1479643