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2-[(p-Toluenesulfonymethylidene]-1,3-dithiane
SpectraBase Compound ID KqLVHZDy39X
InChI InChI=1S/C12H14O2S3/c1-10-3-5-11(6-4-10)17(13,14)9-12-15-7-2-8-16-12/h3-6,9H,2,7-8H2,1H3
InChIKey SJRQKFWDEVUBJA-UHFFFAOYSA-N
Mol Weight 286.42 g/mol
Molecular Formula C12H14O2S3
Exact Mass 286.015593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID erWufROvHr
Name 2-[(p-Toluenesulfonymethylidene]-1,3-dithiane
Alternate Name(s) 1,3-Dithian-2-ylidenemethyl 4-methylphenyl sulfone 2-{[(4-methylphenyl)sulfonyl]methylene}-1,3-dithiane 2-(p-tolylsulfonylmethylene)-1,3-dithiane 2-[(4-methylphenyl)sulfonylmethylidene]-1,3-dithiane
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Formula C12H14O2S3
InChI InChI=1S/C12H14O2S3/c1-10-3-5-11(6-4-10)17(13,14)9-12-15-7-2-8-16-12/h3-6,9H,2,7-8H2,1H3
InChIKey SJRQKFWDEVUBJA-UHFFFAOYSA-N
Molecular Weight 286.422 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)=C1SCCCS1
SPLASH splash10-000e-9460000000-58cc9137af44006cf35d
Source of Spectrum J-63-7918-26
Wiley ID 1289363