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2,2'-di-O-methylimbricaric acid
SpectraBase Compound ID 7XKu4wc3xJD
InChI InChI=1S/C25H32O7/c1-6-8-9-11-17-12-18(29-3)14-21(31-5)23(17)25(28)32-19-13-16(10-7-2)22(24(26)27)20(15-19)30-4/h12-15H,6-11H2,1-5H3,(H,26,27)
InChIKey DFARAUPKJWGCDA-UHFFFAOYSA-N
Mol Weight 444.5 g/mol
Molecular Formula C25H32O7
Exact Mass 444.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rDcZgCahGC
Name 2,2'-di-O-methylimbricaric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32O7
InChI InChI=1S/C25H32O7/c1-6-8-9-11-17-12-18(29-3)14-21(31-5)23(17)25(28)32-19-13-16(10-7-2)22(24(26)27)20(15-19)30-4/h12-15H,6-11H2,1-5H3,(H,26,27)
InChIKey DFARAUPKJWGCDA-UHFFFAOYSA-N
Molecular Weight 444.524 g/mol
SMILES OC(c1c(cc(OC(c2c(cc(cc2CCCCC)OC)OC)=O)cc1OC)CCC)=O
SPLASH splash10-000i-0090000000-4a043d39397a0090e1ce
Source of Spectrum B-46-301-0
Synonyms 4-[(2,4-dimethoxy-6-pentylbenzoyl)oxy]-2-methoxy-6-propylbenzoic acid
Wiley ID 1386040