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2-Chloro-1-(phenylthio)hexane
SpectraBase Compound ID DqFNZkSyUl
InChI InChI=1S/C12H17ClS/c1-2-3-7-11(13)10-14-12-8-5-4-6-9-12/h4-6,8-9,11H,2-3,7,10H2,1H3
InChIKey OKIZWBMFDAHTBB-UHFFFAOYSA-N
Mol Weight 228.78 g/mol
Molecular Formula C12H17ClS
Exact Mass 228.073949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hR4fLoLVq8
Name 2-Chloro-1-(phenylthio)hexane
Alternate Name(s) 2-Chlorohexyl phenyl sulfide [(2-Chlorohexyl)sulfanyl]benzene
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Formula C12H17ClS
InChI InChI=1S/C12H17ClS/c1-2-3-7-11(13)10-14-12-8-5-4-6-9-12/h4-6,8-9,11H,2-3,7,10H2,1H3
InChIKey OKIZWBMFDAHTBB-UHFFFAOYSA-N
Molecular Weight 228.781 g/mol
SMILES C(C(CCCC)Cl)Sc1ccccc1
SPLASH splash10-03mi-0930000000-87cd944f16eb2acf8ed4
Source of Spectrum F-50-12404-26
Wiley ID 789790