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4-Butyl-1,3,8-dihydroxy-6,8-dimethoxyanthraquinone
SpectraBase Compound ID CVQ4ALyTJRn
InChI InChI=1S/C20H20O6/c1-4-5-6-11-13(21)9-14(22)18-17(11)19(23)12-7-10(25-2)8-15(26-3)16(12)20(18)24/h7-9,21-22H,4-6H2,1-3H3
InChIKey KJSMJXOFHQMWCI-UHFFFAOYSA-N
Mol Weight 356.37 g/mol
Molecular Formula C20H20O6
Exact Mass 356.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ec4hIZJZPfg
Name 4-Butyl-1,3,8-dihydroxy-6,8-dimethoxyanthraquinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O6
InChI InChI=1S/C20H20O6/c1-4-5-6-11-13(21)9-14(22)18-17(11)19(23)12-7-10(25-2)8-15(26-3)16(12)20(18)24/h7-9,21-22H,4-6H2,1-3H3
InChIKey KJSMJXOFHQMWCI-UHFFFAOYSA-N
Molecular Weight 356.374 g/mol
SMILES Oc1cc(c(c2C(c3cc(cc(c3C(c12)=O)OC)OC)=O)CCCC)O
SPLASH splash10-03di-0009000000-fdf9e108259f5f3cfb3d
Source of Spectrum X2-50-1082-8
Synonyms 1-butyl-2,4-dihydroxy-5,7-dimethoxyanthra-9,10-quinone
Wiley ID 1602495