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p-chlorobenzenethiol
SpectraBase Compound ID 7uuIBtuAvti
InChI InChI=1S/C6H5ClS/c7-5-1-3-6(8)4-2-5/h1-4,8H
InChIKey VZXOZSQDJJNBRC-UHFFFAOYSA-N
Mol Weight 144.62 g/mol
Molecular Formula C6H5ClS
Exact Mass 143.980049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AwONXJpVyFe
Name p-Chlorothiophenol
Source of Sample Metabolite of Carbophenothion
CAS Registry Number 106-54-7
Classification Pesticides: Artifacts, Degradation product, Metabolites
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 143.980049035 u
Formula C6H5ClS
InChI InChI=1S/C6H5ClS/c7-5-1-3-6(8)4-2-5/h1-4,8H
InChIKey VZXOZSQDJJNBRC-UHFFFAOYSA-N
Molecular Weight 144.619 g/mol
Number of Peaks 99
RI1 1155
RI2 1115
SMILES Sc1ccc(cc1)Cl
SPLASH splash10-0a4l-4900000000-3c8dab204e32c74806fe
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzenethiol, 4-chloro-
Wiley ID LM_PEST_1049