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Bis(2-isopropyl-5-methylcyclohexyl) terephthalate
SpectraBase Compound ID 6mgw1kYqmB0
InChI InChI=1S/C28H42O4/c1-17(2)23-13-7-19(5)15-25(23)31-27(29)21-9-11-22(12-10-21)28(30)32-26-16-20(6)8-14-24(26)18(3)4/h9-12,17-20,23-26H,7-8,13-16H2,1-6H3
InChIKey TWKMCDHWTSQHIJ-UHFFFAOYSA-N
Mol Weight 442.6 g/mol
Molecular Formula C28H42O4
Exact Mass 442.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HJiwx7GDAl
Name Bis(2-isopropyl-5-methylcyclohexyl) terephthalate
Alternate Name(s) benzene-1,4-dicarboxylic acid bis(2-isopropyl-5-methyl-cyclohexyl) ester benzene-1,4-dicarboxylic acid bis(5-methyl-2-propan-2-ylcyclohexyl) ester bis(2-isopropyl-5-methyl-cyclohexyl) benzene-1,4-dicarboxylate bis(5-methyl-2-propan-2-yl-cyclohexyl) benzene-1,4-dicarboxylate Terephthalic acid, di-(-)-menthyl ester
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Formula C28H42O4
InChI InChI=1S/C28H42O4/c1-17(2)23-13-7-19(5)15-25(23)31-27(29)21-9-11-22(12-10-21)28(30)32-26-16-20(6)8-14-24(26)18(3)4/h9-12,17-20,23-26H,7-8,13-16H2,1-6H3
InChIKey TWKMCDHWTSQHIJ-UHFFFAOYSA-N
Molecular Weight 442.640 g/mol
SMILES CC1CCC(C(OC(c2ccc(cc2)C(=O)OC2C(CCC(C2)C)C(C)C)=O)C1)C(C)C
SPLASH splash10-000j-7900000000-f1bf20cad1ef6da9b292
Wiley ID 1496261