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1-methoxy-4-(2''-methylprop-2''-enyloxy)-2-(prop-2'-enyl)anthraquinone
SpectraBase Compound ID 23faxCEMH6U
InChI InChI=1S/C22H20O4/c1-5-8-14-11-17(26-12-13(2)3)18-19(22(14)25-4)21(24)16-10-7-6-9-15(16)20(18)23/h5-7,9-11H,1-2,8,12H2,3-4H3
InChIKey MZOSZRMDPBAUHF-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 mD7uZo3pmQ
Name 1-methoxy-4-(2''-methylprop-2''-enyloxy)-2-(prop-2'-enyl)anthraquinone
Alternate Name(s) 1-Methoxy-4-(2''-methylprop-2''-enyloxy)-2-(prop-2'-enyl)anthraquinone 2-allyl-1-methoxy-4-[(2-methyl-2-propenyl)oxy]anthra-9,10-quinone
Comments Less than 3 mono-isotopic peaks
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Formula C22H20O4
InChI InChI=1S/C22H20O4/c1-5-8-14-11-17(26-12-13(2)3)18-19(22(14)25-4)21(24)16-10-7-6-9-15(16)20(18)23/h5-7,9-11H,1-2,8,12H2,3-4H3
InChIKey MZOSZRMDPBAUHF-UHFFFAOYSA-N
Molecular Weight 348.398 g/mol
SMILES c12c(C(=O)c3c(C2=O)cccc3)c(OC)c(cc1OCC(=C)C)CC=C
SPLASH splash10-001j-0009000000-e2c9505bfd583f5128e6
Source of Spectrum B-47-1321-0
Wiley ID 1340919