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1,2-Bis(4-(2,3-dihydroxybenzyl)-2,3-dihydroxyphenyl)ethane
SpectraBase Compound ID 3clHB8G14sz
InChI InChI=1S/C28H26O8/c29-21-5-1-3-17(23(21)31)13-19-11-9-15(25(33)27(19)35)7-8-16-10-12-20(28(36)26(16)34)14-18-4-2-6-22(30)24(18)32/h1-6,9-12,29-36H,7-8,13-14H2
InChIKey KEOWPVSKVUJFJP-UHFFFAOYSA-N
Mol Weight 490.51 g/mol
Molecular Formula C28H26O8
Exact Mass 490.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ki962HDlOfC
Name 1,2-Bis(4-(2,3-dihydroxybenzyl)-2,3-dihydroxyphenyl)ethane
Alternate Name(s) 3-(2,3-dihydroxybenzyl)-6-{2-[4-(2,3-dihydroxybenzyl)-2,3-dihydroxyphenyl]ethyl}-1,2-benzenediol
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Formula C28H26O8
InChI InChI=1S/C28H26O8/c29-21-5-1-3-17(23(21)31)13-19-11-9-15(25(33)27(19)35)7-8-16-10-12-20(28(36)26(16)34)14-18-4-2-6-22(30)24(18)32/h1-6,9-12,29-36H,7-8,13-14H2
InChIKey KEOWPVSKVUJFJP-UHFFFAOYSA-N
Molecular Weight 490.508 g/mol
SMILES Oc1c(c(Cc2c(c(c(CCc3ccc(Cc4c(c(ccc4)O)O)c(c3O)O)cc2)O)O)ccc1)O
SPLASH splash10-00r2-0596000000-569174dfecbad3449cc0
Source of Spectrum F-52-2393-21
Wiley ID 795316