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3-Benzyl-4-(phenylthio)-3-sulfolene
SpectraBase Compound ID 4opvnyrbBhb
InChI InChI=1S/C17H16O2S2/c18-21(19)12-15(11-14-7-3-1-4-8-14)17(13-21)20-16-9-5-2-6-10-16/h1-10H,11-13H2
InChIKey WOHBWHSRQOOMEX-UHFFFAOYSA-N
Mol Weight 316.43 g/mol
Molecular Formula C17H16O2S2
Exact Mass 316.059172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BbYCoVUwQO
Name 3-Benzyl-4-(phenylthio)-3-sulfolene
Alternate Name(s) 3-Benzyl-4-(phenylsulfanyl)-2,5-dihydrothiophene 1,1-dioxide 4-Benzyl-1,1-dioxido-2,5-dihydro-3-thienyl phenyl sulfide
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Formula C17H16O2S2
InChI InChI=1S/C17H16O2S2/c18-21(19)12-15(11-14-7-3-1-4-8-14)17(13-21)20-16-9-5-2-6-10-16/h1-10H,11-13H2
InChIKey WOHBWHSRQOOMEX-UHFFFAOYSA-N
Molecular Weight 316.433 g/mol
SMILES C1S(CC(=C1Sc1ccccc1)Cc1ccccc1)(=O)=O
SPLASH splash10-00kf-2913000000-ac642c2e997cf96d4d14
Source of Spectrum QA-40-466-3
Wiley ID 861675