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Benzene, 1,1'-[(1-phenyltridecylidene)bis(thio)]bis-
SpectraBase Compound ID GXbu6e9BeAw
InChI InChI=1S/C31H40S2/c1-2-3-4-5-6-7-8-9-10-20-27-31(28-21-14-11-15-22-28,32-29-23-16-12-17-24-29)33-30-25-18-13-19-26-30/h11-19,21-26H,2-10,20,27H2,1H3
InChIKey SRYRMMQDKSISEV-UHFFFAOYSA-N
Mol Weight 476.8 g/mol
Molecular Formula C31H40S2
Exact Mass 476.257144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gnbPanHLLM
Name Benzene, 1,1'-[(1-phenyltridecylidene)bis(thio)]bis-
Alternate Name(s) 1,1-bis(phenylthio)-1-phenyltridecane 1-Phenyl-1,1-bis(phenylthio)tridecane [1,1-Bis(phenylsulfanyl)tridecyl]benzene
CAS Registry Number 77829-72-2
Comments Less than 3 mono-isotopic peaks
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Formula C31H40S2
InChI InChI=1S/C31H40S2/c1-2-3-4-5-6-7-8-9-10-20-27-31(28-21-14-11-15-22-28,32-29-23-16-12-17-24-29)33-30-25-18-13-19-26-30/h11-19,21-26H,2-10,20,27H2,1H3
InChIKey SRYRMMQDKSISEV-UHFFFAOYSA-N
Molecular Weight 476.781 g/mol
SMILES C(Sc1ccccc1)(Sc1ccccc1)(c1ccccc1)CCCCCCCCCCCC
SPLASH splash10-03xr-0905000000-7945317bc23bce9fd5df
Source of Spectrum KC-1986-187-0
Wiley ID 1394443