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5,5'-(dodecane-1,12-diyl)bis(2-methylbenzene-1,3-diol)
SpectraBase Compound ID 1PAyJbHTmQq
InChI InChI=1S/C26H38O4/c1-19-23(27)15-21(16-24(19)28)13-11-9-7-5-3-4-6-8-10-12-14-22-17-25(29)20(2)26(30)18-22/h15-18,27-30H,3-14H2,1-2H3
InChIKey OPVUGBXKVMTYNA-UHFFFAOYSA-N
Mol Weight 414.6 g/mol
Molecular Formula C26H38O4
Exact Mass 414.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5peERkIXSRx
Name 5,5'-(dodecane-1,12-diyl)bis(2-methylbenzene-1,3-diol)
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O4
InChI InChI=1S/C26H38O4/c1-19-23(27)15-21(16-24(19)28)13-11-9-7-5-3-4-6-8-10-12-14-22-17-25(29)20(2)26(30)18-22/h15-18,27-30H,3-14H2,1-2H3
InChIKey OPVUGBXKVMTYNA-UHFFFAOYSA-N
Molecular Weight 414.586 g/mol
SMILES Oc1c(c(cc(c1)CCCCCCCCCCCCc1cc(O)c(c(c1)O)C)O)C
SPLASH splash10-0f79-9700200000-06ccf09df899357d63aa
Source of Spectrum JA-50-747-0
Synonyms 5-[12-(3,5-dihydroxy-4-methylphenyl)dodecyl]-2-methyl-1,3-benzenediol 5-[12-(3,5-dihydroxy-4-methylphenyl)dodecyl]-2-methylbenzene-1,3-diol 5-[12-(3,5-dihydroxy-4-methyl-phenyl)dodecyl]-2-methyl-benzene-1,3-diol 2-Methyl-5-[12-[4-methyl-3,5-bis(oxidanyl)phenyl]dodecyl]benzene-1,3-diol
Wiley ID 1375626