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r-2-Carbomethoxy-cis-4,cis-6-dimethyl-1,3-dithiane trans-oxide
SpectraBase Compound ID HKPxhwcGDPU
InChI InChI=1S/C8H14O3S2/c1-5-4-6(2)13(10)8(12-5)7(9)11-3/h5-6,8H,4H2,1-3H3/t5-,6+,8-,13?/m0/s1
InChIKey YMORWDLXKZVANG-CMQSYRLUSA-N
Mol Weight 222.32 g/mol
Molecular Formula C8H14O3S2
Exact Mass 222.038437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DeQ8E0UfJv
Name r-2-Carbomethoxy-cis-4,cis-6-dimethyl-1,3-dithiane trans-oxide
Alternate Name(s) (2S,4S,6R)-4,6-dimethyl-1-oxo-1,3-dithiane-2-carboxylic acid methyl ester methyl (2S,4S,6R)-4,6-dimethyl-1-oxo-1,3-dithiane-2-carboxylate methyl (2S,4S,6R)-4,6-dimethyl-1-oxidanylidene-1,3-dithiane-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C8H14O3S2
InChI InChI=1S/C8H14O3S2/c1-5-4-6(2)13(10)8(12-5)7(9)11-3/h5-6,8H,4H2,1-3H3/t5-,6+,8-,13?/m0/s1
InChIKey YMORWDLXKZVANG-CMQSYRLUSA-N
Molecular Weight 222.317 g/mol
SMILES [C@@]1(S([C@](C)(C[C@@](S1)(C)[H])[H])=O)(C(=O)OC)[H]
SPLASH splash10-014i-9000000000-972617f9053712335705
Source of Spectrum J-64-5624-4
Wiley ID 1530734