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Benzene, 1,1'-[[6,6-bis(phenylthio)hexylidene]bis(thio)]bis[4-(1,1-dimethylethyl)-
SpectraBase Compound ID BeXhE9ao4DF
InChI InChI=1S/C38H46S4/c1-37(2,3)29-21-25-33(26-22-29)41-36(42-34-27-23-30(24-28-34)38(4,5)6)20-14-13-19-35(39-31-15-9-7-10-16-31)40-32-17-11-8-12-18-32/h7-12,15-18,21-28,35-36H,13-14,19-20H2,1-6H3
InChIKey LPJUQBDLPNZQIY-UHFFFAOYSA-N
Mol Weight 631.0 g/mol
Molecular Formula C38H46S4
Exact Mass 630.248236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CICKS3IFOt
Name Benzene, 1,1'-[[6,6-bis(phenylthio)hexylidene]bis(thio)]bis[4-(1,1-dimethylethyl)-
CAS Registry Number 83711-10-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H46S4
InChI InChI=1S/C38H46S4/c1-37(2,3)29-21-25-33(26-22-29)41-36(42-34-27-23-30(24-28-34)38(4,5)6)20-14-13-19-35(39-31-15-9-7-10-16-31)40-32-17-11-8-12-18-32/h7-12,15-18,21-28,35-36H,13-14,19-20H2,1-6H3
InChIKey LPJUQBDLPNZQIY-UHFFFAOYSA-N
Molecular Weight 631.026 g/mol
SMILES C(Sc1ccc(C(C)(C)C)cc1)(Sc1ccc(C(C)(C)C)cc1)CCCCC(Sc1ccccc1)Sc1ccccc1
SPLASH splash10-000i-0920100000-eb2097f24c2a3ab7d979
Source of Spectrum C-104-7147-0
Synonyms 1,1-bis(phenylthio)-6,6-bis(p-tert-butylphenyl)thio)hexane 1-tert-Butyl-4-{[1-[(4-tert-butylphenyl)sulfanyl]-6,6-bis(phenylsulfanyl)hexyl]sulfanyl}benzene
Wiley ID 1412117