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(11-Chloroundecylthio)benzene
SpectraBase Compound ID JszwYgy7lvy
InChI InChI=1S/C17H27ClS/c18-15-11-6-4-2-1-3-5-7-12-16-19-17-13-9-8-10-14-17/h8-10,13-14H,1-7,11-12,15-16H2
InChIKey JGSMMVKWJMOIGI-UHFFFAOYSA-N
Mol Weight 298.92 g/mol
Molecular Formula C17H27ClS
Exact Mass 298.1522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxUTZiIrtvT
Name (11-Chloroundecylthio)benzene
Alternate Name(s) 11-Chloranylundecylsulfanylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C17H27ClS
InChI InChI=1S/C17H27ClS/c18-15-11-6-4-2-1-3-5-7-12-16-19-17-13-9-8-10-14-17/h8-10,13-14H,1-7,11-12,15-16H2
InChIKey JGSMMVKWJMOIGI-UHFFFAOYSA-N
Molecular Weight 298.916 g/mol
SMILES c1(SCCCCCCCCCCCCl)ccccc1
SPLASH splash10-03di-0920000000-0b160092c327f3a81923
Source of Spectrum J-58-2412-12
Wiley ID 1301005