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4,4'-DIHEXANOYL-2,2',6,6'-DIPHENICDILACTONE
SpectraBase Compound ID KSBMM0GaZfs
InChI InChI=1S/C26H26O8/c1-3-5-7-9-21(27)31-15-11-17-23-19(13-15)33-26(30)18-12-16(32-22(28)10-8-6-4-2)14-20(24(18)23)34-25(17)29/h11-14H,3-10H2,1-2H3
InChIKey WPJAKGLRZKBIAI-UHFFFAOYSA-N
Mol Weight 466.49 g/mol
Molecular Formula C26H26O8
Exact Mass 466.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Lm6rLa0Rt5
Name 4,4'-bis(Hexanoyl)-Ellagic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26O8
InChI InChI=1S/C26H26O8/c1-3-5-7-9-21(27)31-15-11-17-23-19(13-15)33-26(30)18-12-16(32-22(28)10-8-6-4-2)14-20(24(18)23)34-25(17)29/h11-14H,3-10H2,1-2H3
InChIKey WPJAKGLRZKBIAI-UHFFFAOYSA-N
Molecular Weight 466.486 g/mol
SMILES c12-c3c4cc(cc3OC(c1cc(cc2OC4=O)OC(=O)CCCCC)=O)OC(=O)CCCCC
SPLASH splash10-00di-1091000000-75016ef78beca102418a
Source of Spectrum X2-55-1405-4
Synonyms 4,4'-bis(Hexanoyl)diphenic-2,2',6,6'-dilactone 7-(hexanoyloxy)-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-2-yl hexanoate
Wiley ID 1604581