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3-O-(2-METHOXY-3-METHYL-BUT-3-ENYL)-EMODIN
SpectraBase Compound ID DVgJE1qLtHx
InChI InChI=1S/C21H20O6/c1-10(2)17(26-4)9-27-12-7-14-19(16(23)8-12)21(25)18-13(20(14)24)5-11(3)6-15(18)22/h5-8,17,22-23H,1,9H2,2-4H3
InChIKey TTZZEQICBDRDET-UHFFFAOYSA-N
Mol Weight 368.39 g/mol
Molecular Formula C21H20O6
Exact Mass 368.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRc6g39A9jO
Name 1,8-dihydroxy-3-(2-methoxy-3-methyl-but-3-enoxy)-6-methyl-9,10-anthraquinone
Comments Less than 3 mono-isotopic peaks
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Formula C21H20O6
InChI InChI=1S/C21H20O6/c1-10(2)17(26-4)9-27-12-7-14-19(16(23)8-12)21(25)18-13(20(14)24)5-11(3)6-15(18)22/h5-8,17,22-23H,1,9H2,2-4H3
InChIKey TTZZEQICBDRDET-UHFFFAOYSA-N
Molecular Weight 368.385 g/mol
SMILES Oc1cc(cc2c1C(c1c(cc(cc1C2=O)C)O)=O)OCC(C(=C)C)OC
SPLASH splash10-014i-0091000000-cfe6dca2ef1721796ae6
Source of Spectrum G4-63-20-2
Synonyms 1,8-dihydroxy-3-(2-methoxy-3-methyl-but-3-enoxy)-6-methyl-anthracene-9,10-dione 3-(2-methoxy-3-methyl-but-3-enoxy)-6-methyl-1,8-bis(oxidanyl)anthracene-9,10-dione
Wiley ID 1608205