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1-Hydroxy-4-(2''-methylprop-2''-enyloxy)-2-(prop-2'-enyl)anthraquinone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Hydroxy-4-(2''-methylprop-2''-enyloxy)-2-(prop-2'-enyl)anthraquinone
SpectraBase Compound ID FobnZyKkljg
InChI InChI=1S/C21H18O4/c1-4-7-13-10-16(25-11-12(2)3)17-18(19(13)22)21(24)15-9-6-5-8-14(15)20(17)23/h4-6,8-10,22H,1-2,7,11H2,3H3
InChIKey KVFUIRCUDLWRDM-UHFFFAOYSA-N
Mol Weight 334.37 g/mol
Molecular Formula C21H18O4
Exact Mass 334.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FB3OOUIXFe
Name 1-Hydroxy-4-(2''-methylprop-2''-enyloxy)-2-(prop-2'-enyl)anthraquinone
Alternate Name(s) 1-Hydroxy-4-(2''-methylprop-2''-enyloxy)-2-(prop-2'-enyl)anthraquinone 2-Allyl-1-hydroxy-4-[(2-methyl-2-propenyl)oxy]anthra-9,10-quinone
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Formula C21H18O4
InChI InChI=1S/C21H18O4/c1-4-7-13-10-16(25-11-12(2)3)17-18(19(13)22)21(24)15-9-6-5-8-14(15)20(17)23/h4-6,8-10,22H,1-2,7,11H2,3H3
InChIKey KVFUIRCUDLWRDM-UHFFFAOYSA-N
Molecular Weight 334.371 g/mol
SMILES Oc1c2c(C(c3c(cccc3)C2=O)=O)c(cc1CC=C)OCC(=C)C
SPLASH splash10-05o0-2009000000-94a94711069c217d035c
Source of Spectrum B-47-1321-0
Wiley ID 1331201