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2-(acetylthio)-2-(4-chlorophenyl)acetic acid methyl ester
SpectraBase Compound ID 2NCfvgvYxbt
InChI InChI=1S/C11H11ClO3S/c1-7(13)16-10(11(14)15-2)8-3-5-9(12)6-4-8/h3-6,10H,1-2H3
InChIKey ZKWVXDCWKCJQQA-UHFFFAOYSA-N
Mol Weight 258.72 g/mol
Molecular Formula C11H11ClO3S
Exact Mass 258.011743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4G6pXMPrT65
Name 2-(acetylthio)-2-(4-chlorophenyl)acetic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClO3S
InChI InChI=1S/C11H11ClO3S/c1-7(13)16-10(11(14)15-2)8-3-5-9(12)6-4-8/h3-6,10H,1-2H3
InChIKey ZKWVXDCWKCJQQA-UHFFFAOYSA-N
Molecular Weight 258.719 g/mol
SMILES C(C(c1ccc(cc1)Cl)SC(=O)C)(=O)OC
SPLASH splash10-001i-9770000000-48ef1e7169375cbe2c12
Source of Spectrum K1-2003-1787-3
Synonyms Methyl 2-(4-chlorophenyl)-2-ethanoylsulfanyl-ethanoate Methyl 2-acetylsulfanyl-2-(4-chlorophenyl)acetate
Wiley ID 1521070