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2'-Iodobis(1,1':4',1"-terphenyl-4,4"-dimethyl)disulfide
SpectraBase Compound ID FlhATuWPXdW
InChI InChI=1S/C40H31IS2/c41-40-38-5-2-6-39(40)35-21-13-31(14-22-35)27-43-25-29-9-17-33(18-10-29)37-4-1-3-36(23-37)32-15-7-28(8-16-32)24-42-26-30-11-19-34(38)20-12-30/h1-23H,24-27H2
InChIKey VPPWGZKGYIINCF-UHFFFAOYSA-N
Mol Weight 702.7 g/mol
Molecular Formula C40H31IS2
Exact Mass 702.091188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xoVPKhISjv
Name 2'-Iodobis(1,1':4',1"-terphenyl-4,4"-dimethyl)disulfide
Alternate Name(s) 2'-Iodobis(1,1':4',1''-terphenyl-4,4''-dimethyl)disulfide
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Formula C40H31IS2
InChI InChI=1S/C40H31IS2/c41-40-38-5-2-6-39(40)35-21-13-31(14-22-35)27-43-25-29-9-17-33(18-10-29)37-4-1-3-36(23-37)32-15-7-28(8-16-32)24-42-26-30-11-19-34(38)20-12-30/h1-23H,24-27H2
InChIKey VPPWGZKGYIINCF-UHFFFAOYSA-N
Molecular Weight 702.712 g/mol
SMILES c1(c2-c3ccc(cc3)CSCc3ccc(-c4cccc(c4)-c4ccc(CSCc5ccc(-c1ccc2)cc5)cc4)cc3)I
SPLASH splash10-0zfr-0092100800-88fac020d593f9478173
Source of Spectrum F-51-1330-10
Wiley ID 790703