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4-(1-[4-(Benzoyloxy)-3-methylphenyl]-1-methylethyl)-2-methylphenyl benzoate
SpectraBase Compound ID CtW45fCTMC1
InChI InChI=1S/C31H28O4/c1-21-19-25(15-17-27(21)34-29(32)23-11-7-5-8-12-23)31(3,4)26-16-18-28(22(2)20-26)35-30(33)24-13-9-6-10-14-24/h5-20H,1-4H3
InChIKey XZCUKRSDDUSFER-UHFFFAOYSA-N
Mol Weight 464.56 g/mol
Molecular Formula C31H28O4
Exact Mass 464.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBeQQsVl3vK
Name 4-(1-[4-(Benzoyloxy)-3-methylphenyl]-1-methylethyl)-2-methylphenyl benzoate
CAS Registry Number 21886-69-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H28O4
InChI InChI=1S/C31H28O4/c1-21-19-25(15-17-27(21)34-29(32)23-11-7-5-8-12-23)31(3,4)26-16-18-28(22(2)20-26)35-30(33)24-13-9-6-10-14-24/h5-20H,1-4H3
InChIKey XZCUKRSDDUSFER-UHFFFAOYSA-N
Molecular Weight 464.561 g/mol
SMILES c1c(cc(c(c1)OC(=O)c1ccccc1)C)C(C)(C)c1ccc(c(c1)C)OC(=O)c1ccccc1
SPLASH splash10-0a4i-3900000000-3f0fbca9140684db6cc2
Synonyms 5,5'-Isopropylidenebis[2-(benzoyloxy)toluene] benzoic acid [4-[2-(4-benzoyloxy-3-methylphenyl)propan-2-yl]-2-methylphenyl] ester [4-[2-(4-benzoyloxy-3-methylphenyl)propan-2-yl]-2-methylphenyl] benzoate [4-[1-(4-benzoyloxy-3-methyl-phenyl)-1-methyl-ethyl]-2-methyl-phenyl] benzoate [2-methyl-4-[2-[3-methyl-4-(phenylcarbonyloxy)phenyl]propan-2-yl]phenyl] benzoate
Wiley ID 1470127