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(3-Chloro-2,5-dimethylphenylthio)acetic acid
SpectraBase Compound ID JYj799TFbSI
InChI InChI=1S/C10H11ClO2S/c1-6-3-8(11)7(2)9(4-6)14-5-10(12)13/h3-4H,5H2,1-2H3,(H,12,13)
InChIKey CEGLQXFAWIASES-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 ppOrO5qaX3
Name (3-CHLORO-2,5-DIMETHYLPHENYLSULFANYL)ACETIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H11O2SCl
InChI InChI=1S/C10H11ClO2S/c1-6-3-8(11)7(2)9(4-6)14-5-10(12)13/h3-4H,5H2,1-2H3,(H,12,13)
InChIKey CEGLQXFAWIASES-UHFFFAOYSA-N
Molecular Weight 230.0166
SMILES OC(=O)CSc1cc(cc(Cl)c1C)C
SPLASH splash10-0080-1930000000-23468f2670f0d33bf04d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany