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2-(Phenyl-1'-sulfinyl)-3,4-dimethoxyacetophenone
SpectraBase Compound ID 62VUTx1sOjG
InChI InChI=1S/C16H16O4S/c1-19-15-9-8-12(10-16(15)20-2)14(17)11-21(18)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3
InChIKey MLSYGRMZXFJASD-UHFFFAOYSA-N
Mol Weight 304.36 g/mol
Molecular Formula C16H16O4S
Exact Mass 304.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PaLysOQGDB
Name 2-(Phenyl-1'-sulfinyl)-3,4-dimethoxyacetophenone
Alternate Name(s) (+)-(R)-2-(Phenyl-1'-sulfinyl)-3,4-dimethoxyacetophenone 1-(3,4-dimethoxyphenyl)-2-(phenylsulfinyl)ethanone 2-Benzenesulfinyl-1-(3,4-dimethoxy-phenyl)-ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C16H16O4S
InChI InChI=1S/C16H16O4S/c1-19-15-9-8-12(10-16(15)20-2)14(17)11-21(18)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3
InChIKey MLSYGRMZXFJASD-UHFFFAOYSA-N
Molecular Weight 304.360 g/mol
SMILES C(S(=O)c1ccccc1)C(c1cc(OC)c(cc1)OC)=O
SPLASH splash10-0gb9-0907000000-d3a24b1cf197eb8964bf
Source of Spectrum OP-31-115-4
Wiley ID 1577798