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2-Bromo-1,5,7-trimethoxy-3-[4-(2-methyl[1,3]dioxolan-2-yl)-3-oxobuyl]-9,10-anthraquinone
SpectraBase Compound ID 1BV5srPcmda
InChI InChI=1S/C25H25BrO8/c1-25(33-7-8-34-25)12-14(27)6-5-13-9-16-20(24(32-4)21(13)26)23(29)17-10-15(30-2)11-18(31-3)19(17)22(16)28/h9-11H,5-8,12H2,1-4H3
InChIKey RTSVELAMBLNSAP-UHFFFAOYSA-N
Mol Weight 533.37 g/mol
Molecular Formula C25H25BrO8
Exact Mass 532.073281 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LuAhyS6fkH
Name 2-Bromo-1,5,7-trimethoxy-3-[4-(2-methyl[1,3]dioxolan-2-yl)-3-oxobuyl]-9,10-anthraquinone
Alternate Name(s) 2-Bromo-1,5,7-trimethoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]anthracene-9,10-dione 2-Bromo-1,5,7-trimethoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxo-butyl]anthracene-9,10-dione 2-Bromanyl-1,5,7-trimethoxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxidanylidene-butyl]anthracene-9,10-dione
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Formula C25H25BrO8
InChI InChI=1S/C25H25BrO8/c1-25(33-7-8-34-25)12-14(27)6-5-13-9-16-20(24(32-4)21(13)26)23(29)17-10-15(30-2)11-18(31-3)19(17)22(16)28/h9-11H,5-8,12H2,1-4H3
InChIKey RTSVELAMBLNSAP-UHFFFAOYSA-N
Molecular Weight 533.371 g/mol
SMILES c12C(c3cc(OC)cc(c3C(c2cc(c(c1OC)Br)CCC(CC1(OCCO1)C)=O)=O)OC)=O
SPLASH splash10-000i-9000000000-e7bb40d43a5d8222a6a4
Source of Spectrum J-65-3222-8
Wiley ID 1532629