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O-{2-[5-(Phenylsulfinylmethyl)-2,2-dimethyl-1,3-dioxlan-5-yl]-1-methylethyl} O-(p-tolyl) thiocarbonate
SpectraBase Compound ID KwoD8pDEc8V
InChI InChI=1S/C24H30O5S2/c1-18-10-12-20(13-11-18)29-22(30)28-19(2)14-24(15-26-23(3,4)27-16-24)17-31(25)21-8-6-5-7-9-21/h5-13,19H,14-17H2,1-4H3
InChIKey XHMYOQCOEYEHLE-UHFFFAOYSA-N
Mol Weight 462.62 g/mol
Molecular Formula C24H30O5S2
Exact Mass 462.153466 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Rt1sxKNSTW
Name O-{2-[5-(Phenylsulfinylmethyl)-2,2-dimethyl-1,3-dioxlan-5-yl]-1-methylethyl} O-(p-tolyl) thiocarbonate
Alternate Name(s) 1-[5-(benzenesulfinylmethyl)-2,2-dimethyl-1,3-dioxan-5-yl]propan-2-yloxy-(4-methylphenoxy)methanethione 1-[2,2-dimethyl-5-(phenylsulfinylmethyl)-1,3-dioxan-5-yl]propan-2-yloxy-(4-methylphenoxy)methanethione
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Formula C24H30O5S2
InChI InChI=1S/C24H30O5S2/c1-18-10-12-20(13-11-18)29-22(30)28-19(2)14-24(15-26-23(3,4)27-16-24)17-31(25)21-8-6-5-7-9-21/h5-13,19H,14-17H2,1-4H3
InChIKey XHMYOQCOEYEHLE-UHFFFAOYSA-N
Molecular Weight 462.619 g/mol
SMILES C1(CS(=O)c2ccccc2)(COC(OC1)(C)C)CC(OC(=S)Oc1ccc(cc1)C)C
SPLASH splash10-052b-8910000000-5bcb290cdcb28fad435e
Source of Spectrum U1-2002-2756-54
Wiley ID 1522970