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3,3'-Bis((3,5-dichlorophenyl)thio)-1,1'-bi(bicyclo[1.1.1]pentane)
SpectraBase Compound ID Lx9iMOwuAHt
InChI InChI=1S/C22H18Cl4S2/c23-9-1-10(24)4-13(3-9)27-21-15-7-16(21)19(15)20-17-8-18(20)22(17)28-14-5-11(25)2-12(26)6-14/h1-6,15-22H,7-8H2
InChIKey PZDQMGGHYGBSGA-UHFFFAOYSA-N
Mol Weight 488.3 g/mol
Molecular Formula C22H18Cl4S2
Exact Mass 485.960404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SkX8ijwYnp
Name 3,3'-Bis((3,5-dichlorophenyl)thio)-1,1'-bi(bicyclo[1.1.1]pentane)
Appearance White solid
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Formula C22H18Cl4S2
InChI InChI=1S/C22H18Cl4S2/c23-9-1-10(24)4-13(3-9)27-21-15-7-16(21)19(15)20-17-8-18(20)22(17)28-14-5-11(25)2-12(26)6-14/h1-6,15-22H,7-8H2
InChIKey PZDQMGGHYGBSGA-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.114
Molecular Weight 488.318 g/mol
Reported Formula C22H18(35)Cl4(32)S2
SMILES c1(cc(cc(c1)SC1C2CC1C2C1C2CC1C2Sc1cc(cc(c1)Cl)Cl)Cl)Cl
SPLASH splash10-001i-4901000000-03d51b04089b16659511
Source of Spectrum BJO-15-SM17-11c
Thin-Layer Chromatography Rf = 0.49 (pentane)
Wiley ID 1848358