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1-(Benzyloxy)-5-methoxy-2-[ 6'-methyl-4'-oxotetrahydro-2' H-pyran-2'-yl]anthraquinone
SpectraBase Compound ID 3fOl51CgFzO
InChI InChI=1S/C28H24O6/c1-16-13-18(29)14-23(34-16)19-11-12-21-25(28(19)33-15-17-7-4-3-5-8-17)27(31)20-9-6-10-22(32-2)24(20)26(21)30/h3-12,16,23H,13-15H2,1-2H3
InChIKey BXBFEPAWXIBSFU-UHFFFAOYSA-N
Mol Weight 456.49 g/mol
Molecular Formula C28H24O6
Exact Mass 456.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jii75khBNPf
Name 1-(Benzyloxy)-5-methoxy-2-[ 6'-methyl-4'-oxotetrahydro-2' H-pyran-2'-yl]anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24O6
InChI InChI=1S/C28H24O6/c1-16-13-18(29)14-23(34-16)19-11-12-21-25(28(19)33-15-17-7-4-3-5-8-17)27(31)20-9-6-10-22(32-2)24(20)26(21)30/h3-12,16,23H,13-15H2,1-2H3
InChIKey BXBFEPAWXIBSFU-UHFFFAOYSA-N
Molecular Weight 456.494 g/mol
SMILES c12C(c3cccc(c3C(c2ccc(c1OCc1ccccc1)C1OC(CC(C1)=O)C)=O)OC)=O
SPLASH splash10-0006-9023000000-f7bfaacd4f64e896bdfe
Source of Spectrum B-52-313-20
Wiley ID 746546