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.alpha.-(m-Methoxyphenylthio)propiophenone
SpectraBase Compound ID JTLAhmMLBQs
InChI InChI=1S/C16H16O2S/c1-12(16(17)13-7-4-3-5-8-13)19-15-10-6-9-14(11-15)18-2/h3-12H,1-2H3
InChIKey XNGMTQXJOQRPIA-UHFFFAOYSA-N
Mol Weight 272.36 g/mol
Molecular Formula C16H16O2S
Exact Mass 272.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJzGMY4XkR2
Name .alpha.-(m-Methoxyphenylthio)propiophenone
Alternate Name(s) 2-[(3-methoxyphenyl)thio]-1-phenyl-1-propanone 2-(3-methoxyphenyl)sulfanyl-1-phenylpropan-1-one 2-(3-methoxyphenyl)sulfanyl-1-phenyl-propan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H16O2S
InChI InChI=1S/C16H16O2S/c1-12(16(17)13-7-4-3-5-8-13)19-15-10-6-9-14(11-15)18-2/h3-12H,1-2H3
InChIKey XNGMTQXJOQRPIA-UHFFFAOYSA-N
Molecular Weight 272.362 g/mol
SMILES C(C(Sc1cc(OC)ccc1)C)(=O)c1ccccc1
SPLASH splash10-014i-0950000000-5079dc6d6ce9bf717dd1
Source of Spectrum E1-58-1351-0
Wiley ID 1661954