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Bis(4-chlorophenylthio)methane
SpectraBase Compound ID IYCzidGEH0a
InChI InChI=1S/C13H10Cl2S2/c14-10-1-5-12(6-2-10)16-9-17-13-7-3-11(15)4-8-13/h1-8H,9H2
InChIKey NTZBITFHYUVXFR-UHFFFAOYSA-N
Mol Weight 301.25 g/mol
Molecular Formula C13H10Cl2S2
Exact Mass 299.960098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hz1yRYHDH0D
Name Bis(4-chlorophenylthio)methane
Source of Sample Artifact of Carbophenothion-methyl oxygen-analogue
CAS Registry Number 2393-97-7
Classification Pesticides: Artifacts
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 299.960098070 u
Formula C13H10Cl2S2
InChI InChI=1S/C13H10Cl2S2/c14-10-1-5-12(6-2-10)16-9-17-13-7-3-11(15)4-8-13/h1-8H,9H2
InChIKey NTZBITFHYUVXFR-UHFFFAOYSA-N
Molecular Weight 301.249 g/mol
Number of Peaks 207
RI1 2389
RI2 2300
SMILES C(Sc1ccc(cc1)Cl)Sc1ccc(cc1)Cl
SPLASH splash10-0a4i-5900000000-a58b3690de9eb242ee0d
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 Benzene, 1,1'-[methylenebis(thio)]bis[4-chloro-
Wiley ID LM_PEST_1052