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3-[(p-chlorophenyl)thio]propionic acid, methyl ester
SpectraBase Compound ID BOHdpKCk7JP
InChI InChI=1S/C10H11ClO2S/c1-13-10(12)6-7-14-9-4-2-8(11)3-5-9/h2-5H,6-7H2,1H3
InChIKey DAMGUOXWBLUJSL-UHFFFAOYSA-N
Mol Weight 230.71 g/mol
Molecular Formula C10H11ClO2S
Exact Mass 230.016828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iy9GJdqLZJq
Name Methyl 3-[(p-chlorophenyl)thio]-propanoate
Alternate Name(s) 3-[(4-chlorophenyl)thio]propanoic acid methyl ester Methyl 3-(4-chlorophenyl)sulfanylpropanoate
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Formula C10H11ClO2S
InChI InChI=1S/C10H11ClO2S/c1-13-10(12)6-7-14-9-4-2-8(11)3-5-9/h2-5H,6-7H2,1H3
InChIKey DAMGUOXWBLUJSL-UHFFFAOYSA-N
Molecular Weight 230.709 g/mol
SMILES C(CCSc1ccc(cc1)Cl)(=O)OC
SPLASH splash10-0a59-2980000000-47ee4e95e9914b52353c
Source of Spectrum D9-20-95-11
Wiley ID 1695569