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2-(2,6-diketo-4,4-dimethyl-1-phenyl-cycloheptyl)-2-phenyl-acetic acid
SpectraBase Compound ID Hj93tswtR56
InChI InChI=1S/C23H24O4/c1-22(2)13-18(24)14-23(19(25)15-22,17-11-7-4-8-12-17)20(21(26)27)16-9-5-3-6-10-16/h3-12,20H,13-15H2,1-2H3,(H,26,27)
InChIKey ZQNYVGYQKRMEEU-UHFFFAOYSA-N
Mol Weight 364.44 g/mol
Molecular Formula C23H24O4
Exact Mass 364.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jv4NpXDQy3I
Name 2-(2,6-diketo-4,4-dimethyl-1-phenyl-cycloheptyl)-2-phenyl-acetic acid
CAS Registry Number 106661-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24O4
InChI InChI=1S/C23H24O4/c1-22(2)13-18(24)14-23(19(25)15-22,17-11-7-4-8-12-17)20(21(26)27)16-9-5-3-6-10-16/h3-12,20H,13-15H2,1-2H3,(H,26,27)
InChIKey ZQNYVGYQKRMEEU-UHFFFAOYSA-N
Molecular Weight 364.441 g/mol
SMILES OC(C(C1(C(CC(C)(C)CC(C1)=O)=O)c1ccccc1)c1ccccc1)=O
SPLASH splash10-00lr-9433000000-ad0665f8b230ae5416e7
Source of Spectrum H-68-2145-9
Synonyms 2-(4,4-dimethyl-2,6-dioxo-1-phenyl-cycloheptyl)-2-phenyl-acetic acid 2-[4,4-dimethyl-2,6-bis(oxidanylidene)-1-phenyl-cycloheptyl]-2-phenyl-ethanoic acid
Wiley ID 1351066