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

*Links on SpectraBase are not permalinks.
6,6-Bis-(2-methyl-4-hydroxy-5-tert-butyl-phenyl)-hexanoic acid
SpectraBase Compound ID k761Z9TapT
InChI InChI=1S/C28H40O4/c1-17-13-24(29)22(27(3,4)5)15-20(17)19(11-9-10-12-26(31)32)21-16-23(28(6,7)8)25(30)14-18(21)2/h13-16,19,29-30H,9-12H2,1-8H3,(H,31,32)
InChIKey AEXHHJZXESDRPN-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C28H40O4
Exact Mass 440.29266 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 JpD9x4pgWtW
Name 6,6-Bis-(2-methyl-4-hydroxy-5-tert-butyl-phenyl)-hexanoic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40O4
InChI InChI=1S/C28H40O4/c1-17-13-24(29)22(27(3,4)5)15-20(17)19(11-9-10-12-26(31)32)21-16-23(28(6,7)8)25(30)14-18(21)2/h13-16,19,29-30H,9-12H2,1-8H3,(H,31,32)
InChIKey AEXHHJZXESDRPN-UHFFFAOYSA-N
Molecular Weight 440.624 g/mol
SMILES Oc1c(cc(C(CCCCC(=O)O)c2cc(C(C)(C)C)c(cc2C)O)c(c1)C)C(C)(C)C
SPLASH splash10-000l-3009000000-15d672fd246e8232f61f
Source of Spectrum IC-1171-0-0
Synonyms 6,6-bis(5-tert-butyl-4-hydroxy-2-methylphenyl)hexanoic acid
Wiley ID 1384847