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9,9'-DIBENZOYLSECOISOLARICIRESINOL
SpectraBase Compound ID 5dcSsGyVb48
InChI InChI=1S/C34H34O8/c1-39-31-19-23(13-15-29(31)35)17-27(21-41-33(37)25-9-5-3-6-10-25)28(18-24-14-16-30(36)32(20-24)40-2)22-42-34(38)26-11-7-4-8-12-26/h3-16,19-20,27-28,35-36H,17-18,21-22H2,1-2H3
InChIKey RQQATRNILDTCMJ-UHFFFAOYSA-N
Mol Weight 570.6 g/mol
Molecular Formula C34H34O8
Exact Mass 570.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDXGTLDKgOz
Name 2,3-bis(3'-Methoxy-4'-hydroxyenzyl)butane-1,4-dicarboxylic Acid
Alternate Name(s) 9,9'-Dibenzoyl-seco-isolariciresinol benzoic acid [3-(benzoyloxymethyl)-4-(4-hydroxy-3-methoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butyl] ester [3-(benzoyloxymethyl)-4-(4-hydroxy-3-methoxyphenyl)-2-[(4-hydroxy-3-methoxyphenyl)methyl]butyl] benzoate [3-(benzoyloxymethyl)-4-(4-hydroxy-3-methoxy-phenyl)-2-[(4-hydroxy-3-methoxy-phenyl)methyl]butyl] benzoate [2,3-bis[(3-methoxy-4-oxidanyl-phenyl)methyl]-4-(phenylcarbonyloxy)butyl] benzoate
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Formula C34H34O8
InChI InChI=1S/C34H34O8/c1-39-31-19-23(13-15-29(31)35)17-27(21-41-33(37)25-9-5-3-6-10-25)28(18-24-14-16-30(36)32(20-24)40-2)22-42-34(38)26-11-7-4-8-12-26/h3-16,19-20,27-28,35-36H,17-18,21-22H2,1-2H3
InChIKey RQQATRNILDTCMJ-UHFFFAOYSA-N
Molecular Weight 570.638 g/mol
SMILES Oc1c(cc(CC(C(Cc2ccc(c(c2)OC)O)COC(=O)c2ccccc2)COC(=O)c2ccccc2)cc1)OC
SPLASH splash10-00dr-0701290000-c592c38ce35b03c220c9
Source of Spectrum G4-72-1047-6
Wiley ID 1702104