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1-[(R)-(4-methylphenyl)sulfinyl]-4-phenyl-3-butyn-2-one
SpectraBase Compound ID AaR1KVAfikx
InChI InChI=1S/C17H14O2S/c1-14-7-11-17(12-8-14)20(19)13-16(18)10-9-15-5-3-2-4-6-15/h2-8,11-12H,13H2,1H3
InChIKey STUWICFCGQHHTP-UHFFFAOYSA-N
Mol Weight 282.36 g/mol
Molecular Formula C17H14O2S
Exact Mass 282.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BaYD6Zr749p
Name 1-[(R)-(4-methylphenyl)sulfinyl]-4-phenyl-3-butyn-2-one
Alternate Name(s) 1-[(R)-(4-methylphenyl)sulfinyl]-4-phenyl-but-3-yn-2-one 4-Phenyl-1-[(R)-p-tolylsulfinyl]but-3-yn-2-one
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Formula C17H14O2S
InChI InChI=1S/C17H14O2S/c1-14-7-11-17(12-8-14)20(19)13-16(18)10-9-15-5-3-2-4-6-15/h2-8,11-12H,13H2,1H3
InChIKey STUWICFCGQHHTP-UHFFFAOYSA-N
Molecular Weight 282.357 g/mol
SMILES C([S@](c1ccc(cc1)C)=O)C(C#Cc1ccccc1)=O
SPLASH splash10-000i-4900000000-9c549a455fa36c618ecd
Source of Spectrum QC-10-951-2
Wiley ID 871165