For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Bis(2,4,6-tri-tert-butylbenzyl) Sulfide
SpectraBase Compound ID GgIvLTjqXSQ
InChI InChI=1S/C38H62S/c1-33(2,3)25-19-29(35(7,8)9)27(30(20-25)36(10,11)12)23-39-24-28-31(37(13,14)15)21-26(34(4,5)6)22-32(28)38(16,17)18/h19-22H,23-24H2,1-18H3
InChIKey DTQHQTUXBTVLJL-UHFFFAOYSA-N
Mol Weight 551.0 g/mol
Molecular Formula C38H62S
Exact Mass 550.457223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 30OsOzOq3yf
Name Bis(2,4,6-tri-tert-butylbenzyl) Sulfide
CAS Registry Number 125496-12-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H62S
InChI InChI=1S/C38H62S/c1-33(2,3)25-19-29(35(7,8)9)27(30(20-25)36(10,11)12)23-39-24-28-31(37(13,14)15)21-26(34(4,5)6)22-32(28)38(16,17)18/h19-22H,23-24H2,1-18H3
InChIKey DTQHQTUXBTVLJL-UHFFFAOYSA-N
Molecular Weight 550.974 g/mol
SMILES c1(c(c(C(C)(C)C)cc(c1)C(C)(C)C)CSCc1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C
SPLASH splash10-0a4i-9050010000-c91ee81483fe3d05dff0
Source of Spectrum C-0-2920-2
Synonyms 1,3,5-tritert-butyl-2-{[(2,4,6-tritert-butylbenzyl)sulfanyl]methyl}benzene
Wiley ID 1405799