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Methyl 3-ethyl-4-oxo-3-(phenylthio)pentanoate
SpectraBase Compound ID JsmtDJxxnTK
InChI InChI=1S/C14H18O3S/c1-4-14(11(2)15,10-13(16)17-3)18-12-8-6-5-7-9-12/h5-9H,4,10H2,1-3H3
InChIKey DGGNJJXKPZJNCI-UHFFFAOYSA-N
Mol Weight 266.35 g/mol
Molecular Formula C14H18O3S
Exact Mass 266.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID j0wOCFxgX2
Name Methyl 3-ethyl-4-oxo-3-(phenylthio)pentanoate
Alternate Name(s) Methyl 3-ethyl-4-oxo-3-(phenylsulfanyl)pentanoate
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Formula C14H18O3S
InChI InChI=1S/C14H18O3S/c1-4-14(11(2)15,10-13(16)17-3)18-12-8-6-5-7-9-12/h5-9H,4,10H2,1-3H3
InChIKey DGGNJJXKPZJNCI-UHFFFAOYSA-N
Molecular Weight 266.355 g/mol
SMILES C(CC(=O)OC)(Sc1ccccc1)(C(=O)C)CC
SPLASH splash10-03k9-0950000000-02d7461ae5aaccbda793
Source of Spectrum KC-1981-2756-0
Wiley ID 1269799