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2-acetyl-1-methyl-5-phenyl-4,5-dihydrothiophen-3-one

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2-acetyl-1-methyl-5-phenyl-4,5-dihydrothiophen-3-one
SpectraBase Compound ID HbibhQDmPk0
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
InChIKey ZBYPMLIYUKRHFH-UHFFFAOYSA-N
Mol Weight 234.31 g/mol
Molecular Formula C13H14O2S
Exact Mass 234.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DjeTfhgxfqT
Name 2-acetyl-1-methyl-5-phenyl-4,5-dihydrothiophen-3-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
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
InChIKey ZBYPMLIYUKRHFH-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 234.313 g/mol
Source File Reference MHKO9398