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4-Butyl-1,3,8-trihydroxy-6-methoxyanthraquinone
SpectraBase Compound ID JSTXmDIxooV
InChI InChI=1S/C19H18O6/c1-3-4-5-10-12(20)8-14(22)17-16(10)18(23)11-6-9(25-2)7-13(21)15(11)19(17)24/h6-8,20-22H,3-5H2,1-2H3
InChIKey OJEBYOSVPRKFAX-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C19H18O6
Exact Mass 342.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kt7pYRjdZeV
Name 4-Butyl-1,3,8-trihydroxy-6-methoxyanthraquinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O6
InChI InChI=1S/C19H18O6/c1-3-4-5-10-12(20)8-14(22)17-16(10)18(23)11-6-9(25-2)7-13(21)15(11)19(17)24/h6-8,20-22H,3-5H2,1-2H3
InChIKey OJEBYOSVPRKFAX-UHFFFAOYSA-N
Molecular Weight 342.347 g/mol
SMILES Oc1cc(cc2C(c3c(c(cc(c3CCCC)O)O)C(c12)=O)=O)OC
SPLASH splash10-0f6t-0098000000-7219b75d76a713b27490
Source of Spectrum X2-50-1081-6
Synonyms 1-butyl-2,4,5-trihydroxy-7-methoxyanthra-9,10-quinone
Wiley ID 1602497