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2,9-Dichloro-2,9-di(phenylsulfinyl)decane
SpectraBase Compound ID ILNgIzg5shu
InChI InChI=1S/C22H28Cl2O2S2/c1-21(23,27(25)19-13-7-5-8-14-19)17-11-3-4-12-18-22(2,24)28(26)20-15-9-6-10-16-20/h5-10,13-16H,3-4,11-12,17-18H2,1-2H3
InChIKey NTWYXCWWBYUJOV-UHFFFAOYSA-N
Mol Weight 459.49 g/mol
Molecular Formula C22H28Cl2O2S2
Exact Mass 458.090778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9O3FTt67ltL
Name 2,9-Dichloro-2,9-di(phenylsulfinyl)decane
Alternate Name(s) 2,9-Dichloro-2,19-di(phenylsulfinyl)decane {[1,8-dichloro-1-methyl-8-(phenylsulfinyl)nonyl]sulfinyl}benzene
Comments Less than 3 mono-isotopic peaks
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Formula C22H28Cl2O2S2
InChI InChI=1S/C22H28Cl2O2S2/c1-21(23,27(25)19-13-7-5-8-14-19)17-11-3-4-12-18-22(2,24)28(26)20-15-9-6-10-16-20/h5-10,13-16H,3-4,11-12,17-18H2,1-2H3
InChIKey NTWYXCWWBYUJOV-UHFFFAOYSA-N
Molecular Weight 459.490 g/mol
SMILES C(S(=O)c1ccccc1)(Cl)(CCCCCCC(S(=O)c1ccccc1)(Cl)C)C
SPLASH splash10-004i-4900000000-fa1adb8932150dfabae8
Source of Spectrum F-57-499-27
Wiley ID 1549225