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Benzoic acid, 4-(2-methylbutyl)-, 2-methyl-1,4-phenylene ester
SpectraBase Compound ID BSKlvEEm6DS
InChI InChI=1S/C31H36O4/c1-6-21(3)18-24-8-12-26(13-9-24)30(32)34-28-16-17-29(23(5)20-28)35-31(33)27-14-10-25(11-15-27)19-22(4)7-2/h8-17,20-22H,6-7,18-19H2,1-5H3
InChIKey KKVDPCIQVADOAK-UHFFFAOYSA-N
Mol Weight 472.6 g/mol
Molecular Formula C31H36O4
Exact Mass 472.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DodvFiGsOkw
Name Benzoic acid, 4-(2-methylbutyl)-, 2-methyl-1,4-phenylene ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H36O4
InChI InChI=1S/C31H36O4/c1-6-21(3)18-24-8-12-26(13-9-24)30(32)34-28-16-17-29(23(5)20-28)35-31(33)27-14-10-25(11-15-27)19-22(4)7-2/h8-17,20-22H,6-7,18-19H2,1-5H3
InChIKey KKVDPCIQVADOAK-UHFFFAOYSA-N
Molecular Weight 472.625 g/mol
SMILES CCC(C)Cc1ccc(cc1)C(=O)Oc1ccc(OC(=O)c2ccc(CC(C)CC)cc2)c(C)c1
SPLASH splash10-004i-2900000000-4493aac341afdc79b33c
Source of Spectrum JX-2015-4-778
Synonyms 2-Methyl-1,4-phenylene bis(4-(2-methylbutyl)benzoate) 2-Methylbenzene-1,4-diyl bis[4-(2-methylbutyl)benzoate] 4-(2-Methylbutyl)benzoic acid [3-methyl-4-[[4-(2-methylbutyl)phenyl]-oxomethoxy]phenyl] ester [3-methyl-4-[4-(2-methylbutyl)benzoyl]oxyphenyl] 4-(2-methylbutyl)benzoate [3-methyl-4-[4-(2-methylbutyl)benzoyl]oxy-phenyl] 4-(2-methylbutyl)benzoate [3-methyl-4-[4-(2-methylbutyl)phenyl]carbonyloxy-phenyl] 4-(2-methylbutyl)benzoate
Wiley ID 1726197