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Methyl 4-oxo-3-(2'-oxo-2'-phenylethyl)-tetrahydrothiophene-3-carboxylate
SpectraBase Compound ID 8WJjZRt6n3G
InChI InChI=1S/C14H14O4S/c1-18-13(17)14(9-19-8-12(14)16)7-11(15)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey ILOCWMSMZITEDC-UHFFFAOYSA-N
Mol Weight 278.32 g/mol
Molecular Formula C14H14O4S
Exact Mass 278.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kQ79I8LfCH
Name Methyl 4-oxo-3-(2'-oxo-2'-phenylethyl)-tetrahydrothiophene-3-carboxylate
Alternate Name(s) 4-Oxo-3-phenacyl-3-thiolanecarboxylic acid methyl ester Methyl 4-oxo-3-phenacylthiolane-3-carboxylate Methyl 4-oxo-3-phenacyl-tetrahydrothiophene-3-carboxylate Methyl 4-oxidanylidene-3-phenacyl-thiolane-3-carboxylate
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Formula C14H14O4S
InChI InChI=1S/C14H14O4S/c1-18-13(17)14(9-19-8-12(14)16)7-11(15)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey ILOCWMSMZITEDC-UHFFFAOYSA-N
Molecular Weight 278.322 g/mol
SMILES C1(CC(=O)c2ccccc2)(C(=O)OC)C(=O)CSC1
SPLASH splash10-0a4i-0900000000-8c6aa1b0c9c505f6427f
Source of Spectrum U1-2009-5433-5
Wiley ID 1697289