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3-FORMYL-1-HYDROXY-4-METHOXY-2-(2'-METHYLPROP-2'-ENYL)-ANTHRAQUINONE
SpectraBase Compound ID 3cizWfmz8Ub
InChI InChI=1S/C20H16O5/c1-10(2)8-13-14(9-21)20(25-3)16-15(19(13)24)17(22)11-6-4-5-7-12(11)18(16)23/h4-7,9,24H,1,8H2,2-3H3
InChIKey KJOXEWYXENZKGG-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25S8zclDArX
Name 2-Formyl-1-hydroxy-4-methoxy-2-(2'-methylprop-2'-enyl)anthraquinone
Alternate Name(s) 3-Formyl-1-hydroxy-4-methoxy-2-(2'-methylprop-2'-enyl)anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16O5
InChI InChI=1S/C20H16O5/c1-10(2)8-13-14(9-21)20(25-3)16-15(19(13)24)17(22)11-6-4-5-7-12(11)18(16)23/h4-7,9,24H,1,8H2,2-3H3
InChIKey KJOXEWYXENZKGG-UHFFFAOYSA-N
Molecular Weight 336.343 g/mol
SMILES Oc1c2c(C(=O)c3c(C2=O)cccc3)c(OC)c(c1CC(=C)C)C=O
SPLASH splash10-00dr-0039000000-193ed3f4e76030755a1f
Source of Spectrum B-52-795-36
Wiley ID 746793