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(S)-cis-2-Acetyl-3-oxo-5-phenyl-1-methylthiolane-2-ylide
SpectraBase Compound ID 3WejuLCJqk4
InChI InChI=1S/C13H14O2S/c1-9(14)13-11(15)8-12(16(13)2)10-6-4-3-5-7-10/h3-7,12H,8H2,1-2H3/t12-,16?/m0/s1
InChIKey ZBYPMLIYUKRHFH-HKALDPMFSA-N
Mol Weight 234.31 g/mol
Molecular Formula C13H14O2S
Exact Mass 234.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rKoZ9nuOe
Name (S)-cis-2-Acetyl-3-oxo-5-phenyl-1-methylthiolane-2-ylide
Alternate Name(s) (1S,2S)-5-acetyl-1-methyl-2-phenyl-2,3-dihydrothiophen-4-one (1S,2S)-5-ethanoyl-1-methyl-2-phenyl-2,3-dihydrothiophen-4-one (1S,5S)-2-acetyl-1-methyl-3-oxo-5-phenylthiolan-1-ium-2-ide cis-2-Acetyl-3-oxo-5-phenyl-1-methylthiolane-2-ylide
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Formula C13H14O2S
InChI InChI=1S/C13H14O2S/c1-9(14)13-11(15)8-12(16(13)2)10-6-4-3-5-7-10/h3-7,12H,8H2,1-2H3/t12-,16?/m0/s1
InChIKey ZBYPMLIYUKRHFH-HKALDPMFSA-N
Molecular Weight 234.313 g/mol
SMILES [C-]1([S@@+]([C@@](CC1=O)(c1ccccc1)[H])C)C(=O)C
SPLASH splash10-0016-9220000000-e54aab701e38c70d3bee
Source of Spectrum E1-38-334-7
Wiley ID 1518147