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Bis((1,1-dimethylethyl) p-Methoxybenzoyl 4-Oxocyclohex-2-ene-1,1,3-tricarboxylate
SpectraBase Compound ID 5iMgRhkOxU
InChI InChI=1S/C25H32O8/c1-23(2,3)32-21(28)25(22(29)33-24(4,5)6)13-12-19(26)18(14-25)20(27)31-15-16-8-10-17(30-7)11-9-16/h8-11,14H,12-13,15H2,1-7H3
InChIKey JKUFQLWJQXKZSE-UHFFFAOYSA-N
Mol Weight 460.5 g/mol
Molecular Formula C25H32O8
Exact Mass 460.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChvWLL7o9P3
Name Bis((1,1-dimethylethyl) p-Methoxybenzoyl 4-Oxocyclohex-2-ene-1,1,3-tricarboxylate
Alternate Name(s) 1,1-Ditert-butyl 3-(4-methoxybenzyl) 4-oxo-2-cyclohexene-1,1,3-tricarboxylate 4-Oxocyclohex-2-ene-1,1,3-tricarboxylic acid O1,O1'-ditert-butyl ester O3-[(4-methoxyphenyl)methyl] ester 1-O,1-O'-ditert-butyl 3-O-[(4-methoxyphenyl)methyl] 4-oxocyclohex-2-ene-1,1,3-tricarboxylate O1,O1'-ditert-butyl O3-[(4-methoxyphenyl)methyl] 4-oxocyclohex-2-ene-1,1,3-tricarboxylate O1,O1'-ditert-butyl O3-[(4-methoxyphenyl)methyl] 4-oxidanylidenecyclohex-2-ene-1,1,3-tricarboxylate
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Formula C25H32O8
InChI InChI=1S/C25H32O8/c1-23(2,3)32-21(28)25(22(29)33-24(4,5)6)13-12-19(26)18(14-25)20(27)31-15-16-8-10-17(30-7)11-9-16/h8-11,14H,12-13,15H2,1-7H3
InChIKey JKUFQLWJQXKZSE-UHFFFAOYSA-N
Molecular Weight 460.523 g/mol
SMILES C1(C=C(C(OCc2ccc(cc2)OC)=O)C(CC1)=O)(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O
SPLASH splash10-00di-0900000000-182d8db133ceba685800
Source of Spectrum J-61-5412-24
Wiley ID 1390484