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1-hydroxy-4-methoxy-3-(2'-methylprop-2'-enyl)-2-(prop-2''-enyl)anthraquinone and 1-hydroxy-4-methoxy-2-(2'-methylprop-2'-enyl)-3-(prop-2''-enyl)anthraquinone

View entire compound with spectra: 1 MS (GC)

1-hydroxy-4-methoxy-3-(2'-methylprop-2'-enyl)-2-(prop-2''-enyl)anthraquinone and 1-hydroxy-4-methoxy-2-(2'-methylprop-2'-enyl)-3-(prop-2''-enyl)anthraquinone
SpectraBase Compound ID Ih8wOqnwyib
InChI InChI=1S/C22H20O4/c1-5-8-13-16(11-12(2)3)22(26-4)18-17(19(13)23)20(24)14-9-6-7-10-15(14)21(18)25/h5-7,9-10,23H,1-2,8,11H2,3-4H3
InChIKey JFWBLMHHHWLTQX-UHFFFAOYSA-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 HONdcxSBFLM
Name 1-hydroxy-4-methoxy-3-(2'-methylprop-2'-enyl)-2-(prop-2''-enyl)anthraquinone and 1-hydroxy-4-methoxy-2-(2'-methylprop-2'-enyl)-3-(prop-2''-enyl)anthraquinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20O4
InChI InChI=1S/C22H20O4/c1-5-8-13-16(11-12(2)3)22(26-4)18-17(19(13)23)20(24)14-9-6-7-10-15(14)21(18)25/h5-7,9-10,23H,1-2,8,11H2,3-4H3
InChIKey JFWBLMHHHWLTQX-UHFFFAOYSA-N
Molecular Weight 348.398 g/mol
SMILES Oc1c2c(C(c3c(cccc3)C2=O)=O)c(c(c1CC=C)CC(=C)C)OC
SPLASH splash10-000t-0009000000-7343719dd916a51e3b9a
Source of Spectrum B-47-1321-0
Synonyms 1-Hydroxy-4-methoxy-3-(2'-methylprop-2'-enyl)-2-(prop-2''-enyl)anthraquinone and 1-hydroxy-4-methoxy-2-(2'-methylprop-2'-enyl)-3-(prop-2''-enyl)anthraquinone 2-allyl-1-hydroxy-4-methoxy-3-(2-methyl-2-propenyl)anthra-9,10-quinone
Wiley ID 1340917