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4-Bromo-1,8,11-trimethoxy-3-methylbenz[a]anthracene-7,12-dione
SpectraBase Compound ID HCCKzpyQpLT
InChI InChI=1S/C22H17BrO5/c1-10-9-15(28-4)16-11(20(10)23)5-6-12-17(16)22(25)19-14(27-3)8-7-13(26-2)18(19)21(12)24/h5-9H,1-4H3
InChIKey XZRJGNSNBSPZBU-UHFFFAOYSA-N
Mol Weight 441.28 g/mol
Molecular Formula C22H17BrO5
Exact Mass 440.025937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4VclBnaGS9u
Name 4-Bromo-1,8,11-trimethoxy-3-methylbenz[a]anthracene-7,12-dione
Alternate Name(s) 4-Bromo-1,8,11-trimethoxy-3-methyltetraphene-7,12-dione 4-Bromo-1,8,11-trimethoxy-3-methylbenzo[a]anthracene-7,12-dione 4-Bromo-1,8,11-trimethoxy-3-methyl-benzo[a]anthracene-7,12-dione 4-Bromanyl-1,8,11-trimethoxy-3-methyl-benzo[a]anthracene-7,12-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17BrO5
InChI InChI=1S/C22H17BrO5/c1-10-9-15(28-4)16-11(20(10)23)5-6-12-17(16)22(25)19-14(27-3)8-7-13(26-2)18(19)21(12)24/h5-9H,1-4H3
InChIKey XZRJGNSNBSPZBU-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo202448e
Molecular Weight 441.277 g/mol
SMILES c1cc(c2C(c3c(c4c(cc3)c(c(cc4OC)C)Br)C(c2c1OC)=O)=O)OC
SPLASH splash10-0006-0001900000-550fc5ee94b67619163f
Source of Spectrum J-77-2665-26
Wiley ID 1744976