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1-(3,5-Dibenzyloxyphenyl)hexane-1,3,5-trione
SpectraBase Compound ID 3QLeYNtWP7o
InChI InChI=1S/C26H24O5/c1-19(27)12-23(28)15-26(29)22-13-24(30-17-20-8-4-2-5-9-20)16-25(14-22)31-18-21-10-6-3-7-11-21/h2-11,13-14,16H,12,15,17-18H2,1H3
InChIKey JBKCGGVEQQLUMD-UHFFFAOYSA-N
Mol Weight 416.47 g/mol
Molecular Formula C26H24O5
Exact Mass 416.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FDcrKOMsQf
Name 1-(3,5-Dibenzyloxyphenyl)hexane-1,3,5-trione
Alternate Name(s) 1-(3,5-dibenzoxyphenyl)hexane-1,3,5-trione 1-[3,5-bis(phenylmethoxy)phenyl]hexane-1,3,5-trione
Comments Less than 3 mono-isotopic peaks
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Formula C26H24O5
InChI InChI=1S/C26H24O5/c1-19(27)12-23(28)15-26(29)22-13-24(30-17-20-8-4-2-5-9-20)16-25(14-22)31-18-21-10-6-3-7-11-21/h2-11,13-14,16H,12,15,17-18H2,1H3
InChIKey JBKCGGVEQQLUMD-UHFFFAOYSA-N
Molecular Weight 416.473 g/mol
SMILES c1(C(CC(CC(=O)C)=O)=O)cc(OCc2ccccc2)cc(c1)OCc1ccccc1
SPLASH splash10-0006-9000000000-f4e05d240859d3e2b309
Source of Spectrum KC-0-2608-15
Wiley ID 786745