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1-(RS)-3-(RS)-.alpha.(SR)-.Alpha-(2,6-Dimethoxyphenyl)-1,3-dioxo-1,3-dithiane-2-methanol
SpectraBase Compound ID KgMOZUTCyS4
InChI InChI=1S/C13H18O5S2/c1-17-9-5-3-6-10(18-2)11(9)12(14)13-19(15)7-4-8-20(13)16/h3,5-6,12-14H,4,7-8H2,1-2H3
InChIKey KXUNJNUSWUKDFA-UHFFFAOYSA-N
Mol Weight 318.4 g/mol
Molecular Formula C13H18O5S2
Exact Mass 318.059566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwreoGL2154
Name 1-(RS)-3-(RS)-.alpha.(SR)-.Alpha-(2,6-Dimethoxyphenyl)-1,3-dioxo-1,3-dithiane-2-methanol
Alternate Name(s) 1-(RS)-3-(RS)-.alpha.(RS)-.Alpha-(2,6-Dimethoxyphenyl)-1,3-dioxo-1,3-dithiane-2-methanol (2,6-dimethoxyphenyl)(1,3-dioxido-1,3-dithian-2-yl)methanol 1-(RS)-3-(RS)-.alpha.(RS)-..alpha.-(2,6-Dimethoxyphenyl)-1,3-dioxo-1,3-dithiane-2-methanol 1-(RS)-3-(RS)-.alpha.(SR)-..alpha.-(2,6-Dimethoxyphenyl)-1,3-dioxo-1,3-dithiane-2-methanol
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Formula C13H18O5S2
InChI InChI=1S/C13H18O5S2/c1-17-9-5-3-6-10(18-2)11(9)12(14)13-19(15)7-4-8-20(13)16/h3,5-6,12-14H,4,7-8H2,1-2H3
InChIKey KXUNJNUSWUKDFA-UHFFFAOYSA-N
Molecular Weight 318.402 g/mol
SMILES OC(C1S(=O)CCCS1=O)c1c(OC)cccc1OC
SPLASH splash10-014i-1900000000-e16ae27f32a2837b7014
Source of Spectrum J-60-2180-7
Wiley ID 1318025