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2-[1,3]Dithian-2-yl-3-oxo-3-phenyl-propionic acid ethyl ester
SpectraBase Compound ID 4nLJnilC1Ua
InChI InChI=1S/C15H18O3S2/c1-2-18-14(17)12(15-19-9-6-10-20-15)13(16)11-7-4-3-5-8-11/h3-5,7-8,12,15H,2,6,9-10H2,1H3
InChIKey NWYNAKPRRQQFPP-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C15H18O3S2
Exact Mass 310.069737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WKHle79zHt
Name 2-[1,3]Dithian-2-yl-3-oxo-3-phenyl-propionic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3S2
InChI InChI=1S/C15H18O3S2/c1-2-18-14(17)12(15-19-9-6-10-20-15)13(16)11-7-4-3-5-8-11/h3-5,7-8,12,15H,2,6,9-10H2,1H3
InChIKey NWYNAKPRRQQFPP-UHFFFAOYSA-N
Molecular Weight 310.426 g/mol
SMILES C(C(=O)c1ccccc1)(C1SCCCS1)C(=O)OCC
SPLASH splash10-03e9-0098000000-0e832f920a3eb5150bac
Source of Spectrum F-53-17156-22
Synonyms Ethyl 2-(1,3-dithian-2-yl)-3-oxo-3-phenylpropanoate Ethyl 2-(1,3-dithian-2-yl)-3-oxo-3-phenylpropionate Ethyl 2-(1,3-dithian-2-ylidene)-3-oxo-3-phenylpropionate
Wiley ID 804955