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2-(2'-Methyl-3'-(phenylthio)prop-2'-enyl)-1,3-dioxolane
SpectraBase Compound ID 3VxbQtyVcHw
InChI InChI=1S/C13H16O2S/c1-11(9-13-14-7-8-15-13)10-16-12-5-3-2-4-6-12/h2-6,10,13H,7-9H2,1H3/b11-10+
InChIKey INVCXIFLPQSOMV-ZHACJKMWSA-N
Mol Weight 236.33 g/mol
Molecular Formula C13H16O2S
Exact Mass 236.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GTRDYGoYIM
Name 2-(2'-Methyl-3'-(phenylthio)prop-2'-enyl)-1,3-dioxolane
Alternate Name(s) (1E)-3-(1,3-dioxolan-2-yl)-2-methyl-1-propenyl phenyl sulfide 2-[(2E)-2-methyl-3-(phenylsulfanyl)-2-propenyl]-1,3-dioxolane
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Formula C13H16O2S
InChI InChI=1S/C13H16O2S/c1-11(9-13-14-7-8-15-13)10-16-12-5-3-2-4-6-12/h2-6,10,13H,7-9H2,1H3/b11-10+
InChIKey INVCXIFLPQSOMV-ZHACJKMWSA-N
Molecular Weight 236.329 g/mol
SMILES c1(S\C=C\(CC2OCCO2)C)ccccc1
SPLASH splash10-00fr-9400000000-59ae04d3b2f3bb1c8c61
Source of Spectrum J-61-5302-12
Wiley ID 1237998