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1,2-Cyclohexanedicarboxylic acid, 2-ethyl-3,3-dimethylbutyl 2-ethyl-4-methylpentyl ester
SpectraBase Compound ID EklCsI0IWQJ
InChI InChI=1S/C24H44O4/c1-8-18(14-17(3)4)15-27-22(25)20-12-10-11-13-21(20)23(26)28-16-19(9-2)24(5,6)7/h17-21H,8-16H2,1-7H3
InChIKey PBKOHIXLKPRFQY-UHFFFAOYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C24H44O4
Exact Mass 396.32396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KkrGlmgVKh6
Name 1,2-Cyclohexanedicarboxylic acid, 2-ethyl-3,3-dimethylbutyl 2-ethyl-4-methylpentyl ester
Alternate Name(s) 1-(2-Ethyl-3,3-dimethylbutyl) 2-(2-ethyl-4-methylpentyl) cyclohexane-1,2-dicarboxylate 2-Ethyl-3,3-dimethylbutyl 2-ethyl-4-methylpentyl cyclohexane-1,2-dicarboxylate Cyclohexane-1,2-dicarboxylic acid O2-(2-ethyl-3,3-dimethylbutyl) ester O1-(2-ethyl-4-methylpentyl) ester 2-O-(2-ethyl-3,3-dimethylbutyl) 1-O-(2-ethyl-4-methylpentyl) cyclohexane-1,2-dicarboxylate O2-(2-ethyl-3,3-dimethyl-butyl) O1-(2-ethyl-4-methyl-pentyl) cyclohexane-1,2-dicarboxylate
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Formula C24H44O4
InChI InChI=1S/C24H44O4/c1-8-18(14-17(3)4)15-27-22(25)20-12-10-11-13-21(20)23(26)28-16-19(9-2)24(5,6)7/h17-21H,8-16H2,1-7H3
InChIKey PBKOHIXLKPRFQY-UHFFFAOYSA-N
Molecular Weight 396.612 g/mol
SMILES C(OC(=O)C1CCCCC1C(=O)OCC(C(C)(C)C)CC)C(CC)CC(C)C
SPLASH splash10-0a4l-9710000000-1fb066bc5d218f727442
Source of Spectrum JX-2015-3-1953
Wiley ID 1725412