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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 LxWi4a31yF9
Name Bis(4-chlorophenylthio)methane
Alternate Name(s) 1-chloranyl-4-[(4-chlorophenyl)sulfanylmethylsulfanyl]benzene 1-chloro-4-[[(4-chlorophenyl)thio]methylthio]benzene
CAS Registry Number 2393-97-7
Comments Less than 3 mono-isotopic peaks
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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
SMILES C(Sc1ccc(cc1)Cl)Sc1ccc(cc1)Cl
SPLASH splash10-0a4i-0903000000-aa0124a0814b3e83d682
Source of Spectrum AJ-68-1404-4
Wiley ID 773197