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Phenyl(1-(2,2,2-trichloroethyl)cyclohexyl)sulfane
SpectraBase Compound ID ABZf0gUACsM
InChI InChI=1S/C14H17Cl3S/c15-14(16,17)11-13(9-5-2-6-10-13)18-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2
InChIKey FPKNAEPTWOIHJJ-UHFFFAOYSA-N
Mol Weight 323.71 g/mol
Molecular Formula C14H17Cl3S
Exact Mass 322.011655 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ErPB840Fvol
Name Phenyl(1-(2,2,2-trichloroethyl)cyclohexyl)sulfane
Appearance Colorless oil
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Formula C14H17Cl3S
InChI InChI=1S/C14H17Cl3S/c15-14(16,17)11-13(9-5-2-6-10-13)18-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2
InChIKey FPKNAEPTWOIHJJ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000657
Molecular Weight 323.709 g/mol
Reported Formula C14H17Cl3S
SMILES C1CCCCC1(CC(Cl)(Cl)Cl)Sc1ccccc1
SPLASH splash10-03di-3900000000-2089ebb5b2f63027431f
Source of Spectrum ASC-362-SM13-3j
Wiley ID 1855537