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4-[1-azulenyl-[3-[1-azulenyl-(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1-azulenyl]methyl]-2,6-ditert-butylphenol
SpectraBase Compound ID 4zovo6NJlOe
InChI InChI=1S/C60H64O2/c1-57(2,3)49-32-39(33-50(55(49)61)58(4,5)6)53(45-30-28-37-22-16-13-18-24-41(37)45)47-36-48(44-27-21-15-20-26-43(44)47)54(46-31-29-38-23-17-14-19-25-42(38)46)40-34-51(59(7,8)9)56(62)52(35-40)60(10,11)12/h13-36,53-54,61-62H,1-12H3
InChIKey WCXLJVQSGDNGTD-UHFFFAOYSA-N
Mol Weight 817.2 g/mol
Molecular Formula C60H64O2
Exact Mass 816.490631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Nl8NGb5Mdv
Name 4-[1-azulenyl-[3-[1-azulenyl-(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-1-azulenyl]methyl]-2,6-ditert-butylphenol
Alternate Name(s) 4-[azulen-1-yl-[3-[azulen-1-yl-(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]azulen-1-yl]methyl]-2,6-ditert-butyl-phenol 4-[azulen-1-yl-[3-[azulen-1-yl-(3,5-ditert-butyl-4-hydroxyphenyl)methyl]azulen-1-yl]methyl]-2,6-ditert-butylphenol
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Formula C60H64O2
InChI InChI=1S/C60H64O2/c1-57(2,3)49-32-39(33-50(55(49)61)58(4,5)6)53(45-30-28-37-22-16-13-18-24-41(37)45)47-36-48(44-27-21-15-20-26-43(44)47)54(46-31-29-38-23-17-14-19-25-42(38)46)40-34-51(59(7,8)9)56(62)52(35-40)60(10,11)12/h13-36,53-54,61-62H,1-12H3
InChIKey WCXLJVQSGDNGTD-UHFFFAOYSA-N
Molecular Weight 817.170 g/mol
SMILES Oc1c(cc(C(c2c3c(c(C(c4cc(c(c(c4)C(C)(C)C)O)C(C)(C)C)c4c5c(ccccc5)cc4)c2)ccccc3)c2c3c(ccccc3)cc2)cc1C(C)(C)C)C(C)(C)C
SPLASH splash10-0100-0502900080-c01015aa2a15c993ef47
Source of Spectrum J-62-2429-9
Wiley ID 1417393