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Methyl 3-(bis(4-fluorophenyl)methyl)-6-hydroxy-2,4-dimethyl-5-ethylbenzoate
SpectraBase Compound ID DTxRNzgCYWN
InChI InChI=1S/C25H24F2O3/c1-5-20-14(2)21(15(3)22(24(20)28)25(29)30-4)23(16-6-10-18(26)11-7-16)17-8-12-19(27)13-9-17/h6-13,23,28H,5H2,1-4H3
InChIKey GIPFBSWUPQSWKC-UHFFFAOYSA-N
Mol Weight 410.46 g/mol
Molecular Formula C25H24F2O3
Exact Mass 410.169351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfGNg8jtLvN
Name Methyl 3-(bis(4-fluorophenyl)methyl)-6-hydroxy-2,4-dimethyl-5-ethylbenzoate
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Formula C25H24F2O3
InChI InChI=1S/C25H24F2O3/c1-5-20-14(2)21(15(3)22(24(20)28)25(29)30-4)23(16-6-10-18(26)11-7-16)17-8-12-19(27)13-9-17/h6-13,23,28H,5H2,1-4H3
InChIKey GIPFBSWUPQSWKC-UHFFFAOYSA-N
Molecular Weight 410.461 g/mol
SMILES Oc1c(c(c(c(c1C(=O)OC)C)C(c1ccc(cc1)F)c1ccc(cc1)F)C)CC
SPLASH splash10-0f79-0239200000-cdc1c53eb9709d3b622a
Source of Spectrum Rasheed Ahmad Khera, et al. Tetrahedron, V.66, 2010, P.1643-1652
Synonyms Methyl 3-(bis(4-fluorophenyl)methyl)-5-ethyl-6-hydroxy-2,4-dimethylbenzoate
Wiley ID 1816235