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1,6-Bis-(3,5-di-tert-butyl-4-hydroxyphenyl-methyl-thioethylcarboxy)-hexane
SpectraBase Compound ID 1LI9sGcZPLl
InChI InChI=1S/C42H66O6S2/c1-39(2,3)29-21-27(22-30(37(29)45)40(4,5)6)33(49-13)25-47-35(43)19-17-15-16-18-20-36(44)48-26-34(50-14)28-23-31(41(7,8)9)38(46)32(24-28)42(10,11)12/h21-24,33-34,45-46H,15-20,25-26H2,1-14H3
InChIKey SGXBCLVZTZXJNK-UHFFFAOYSA-N
Mol Weight 731.1 g/mol
Molecular Formula C42H66O6S2
Exact Mass 730.430082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1yrgRtZBPaC
Name 1,6-Bis-(3,5-di-tert-butyl-4-hydroxyphenyl-methyl-thioethylcarboxy)-hexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H66O6S2
InChI InChI=1S/C42H66O6S2/c1-39(2,3)29-21-27(22-30(37(29)45)40(4,5)6)33(49-13)25-47-35(43)19-17-15-16-18-20-36(44)48-26-34(50-14)28-23-31(41(7,8)9)38(46)32(24-28)42(10,11)12/h21-24,33-34,45-46H,15-20,25-26H2,1-14H3
InChIKey SGXBCLVZTZXJNK-UHFFFAOYSA-N
Molecular Weight 731.104 g/mol
SMILES Oc1c(cc(C(COC(CCCCCCC(OCC(c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)SC)=O)=O)SC)cc1C(C)(C)C)C(C)(C)C
SPLASH splash10-014l-8190000000-cefb94695d71f5807554
Source of Spectrum IC-1315-0-0
Synonyms bis[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(methylsulfanyl)ethyl]suberate
Wiley ID 1415916