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1-HYDROXY-5-METHOXY-2-(2'-METHYLPROP-2'-ENYL)-6-(PROP-1''-ENYL)-ANTHRAQUINONE
SpectraBase Compound ID BFUR7XO3JBh
InChI InChI=1S/C22H20O4/c1-5-6-13-7-9-16-18(22(13)26-4)21(25)15-10-8-14(11-12(2)3)19(23)17(15)20(16)24/h5-10,23H,2,11H2,1,3-4H3/b6-5+
InChIKey RLSYWSOVDSAPFB-AATRIKPKSA-N
Mol Weight 348.4 g/mol
Molecular Formula C22H20O4
Exact Mass 348.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9NPAdHgyVxT
Name 5-Methoxy-1-hydroxy-2-(2'-methylprop-2'-enyl)-6-(prop-1"-enyl)anthraquinone
Alternate Name(s) 1-Hydroxy-5-methoxy-2-(2-methyl-2-propenyl)-6-[(1E)-1-propenyl]anthra-9,10-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20O4
InChI InChI=1S/C22H20O4/c1-5-6-13-7-9-16-18(22(13)26-4)21(25)15-10-8-14(11-12(2)3)19(23)17(15)20(16)24/h5-10,23H,2,11H2,1,3-4H3/b6-5+
InChIKey RLSYWSOVDSAPFB-AATRIKPKSA-N
Molecular Weight 348.398 g/mol
SMILES Oc1c2C(c3ccc(c(c3C(c2ccc1CC(=C)C)=O)OC)\C=C\C)=O
SPLASH splash10-000t-0009000000-28e32d961df6844e18b6
Source of Spectrum B-52-250-8
Wiley ID 746384