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Bis(1,1-dimethylethyl) p-Methoxybenzyl 4-Oxocyclohexane-1,1,3-tricarboxylate
SpectraBase Compound ID 6UkWqUs2WnY
InChI InChI=1S/C25H34O8/c1-23(2,3)32-20(27)18-14-25(13-12-19(18)26,22(29)33-24(4,5)6)21(28)31-15-16-8-10-17(30-7)11-9-16/h8-11,18H,12-15H2,1-7H3
InChIKey PMIVWFCNYNKVAC-UHFFFAOYSA-N
Mol Weight 462.5 g/mol
Molecular Formula C25H34O8
Exact Mass 462.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDq28Pe0MNT
Name Bis(1,1-dimethylethyl) p-Methoxybenzyl 4-Oxocyclohexane-1,1,3-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O8
InChI InChI=1S/C25H34O8/c1-23(2,3)32-20(27)18-14-25(13-12-19(18)26,22(29)33-24(4,5)6)21(28)31-15-16-8-10-17(30-7)11-9-16/h8-11,18H,12-15H2,1-7H3
InChIKey PMIVWFCNYNKVAC-UHFFFAOYSA-N
Molecular Weight 462.539 g/mol
SMILES C1(C(OC(C)(C)C)=O)(CC(C(OC(C)(C)C)=O)C(CC1)=O)C(OCc1ccc(cc1)OC)=O
SPLASH splash10-00di-0900000000-3a35e02557dd2421b427
Source of Spectrum J-61-5413-33
Synonyms 1,3-Ditert-butyl 1-(4-methoxybenzyl) 4-oxo-1,1,3-cyclohexanetricarboxylate
Wiley ID 1391055