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9-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
SpectraBase Compound ID 7vtqH0XlbPG
InChI InChI=1S/C25H29BrO5/c1-6-30-17-8-13(7-14(26)23(17)29)20-21-15(27)9-24(2,3)11-18(21)31-19-12-25(4,5)10-16(28)22(19)20/h7-8,20,29H,6,9-12H2,1-5H3
InChIKey UZNAHPWJLHCHIH-UHFFFAOYSA-N
Mol Weight 489.41 g/mol
Molecular Formula C25H29BrO5
Exact Mass 488.119837 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JXStsHFe9cq
Name 9-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
Alternate Name(s) 9-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione 9-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-quinone 9-(3-Bromo-5-ethoxy-4-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
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Formula C25H29BrO5
InChI InChI=1S/C25H29BrO5/c1-6-30-17-8-13(7-14(26)23(17)29)20-21-15(27)9-24(2,3)11-18(21)31-19-12-25(4,5)10-16(28)22(19)20/h7-8,20,29H,6,9-12H2,1-5H3
InChIKey UZNAHPWJLHCHIH-UHFFFAOYSA-N
Molecular Weight 489.406 g/mol
SMILES Oc1c(cc(C2C=3C(CC(CC3OC3=C2C(CC(C)(C)C3)=O)(C)C)=O)cc1Br)OCC
SPLASH splash10-0abc-7770900000-8ecafff79f91135d9ba7
Wiley ID 1461183