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5,7-bis(bromanyl)-9-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one
SpectraBase Compound ID LC5Sl13XouW
InChI InChI=1S/C23H24Br2O4/c1-22(2)7-14(26)19(15(27)8-22)18-12-5-11(24)6-13(25)21(12)29-17-10-23(3,4)9-16(28)20(17)18/h5-6,18,26H,7-10H2,1-4H3
InChIKey MKTZLDPJSQVBAV-UHFFFAOYSA-N
Mol Weight 524.25 g/mol
Molecular Formula C23H24Br2O4
Exact Mass 522.004135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TO7P5XLw37
Name 5,7-bis(bromanyl)-9-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one
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Formula C23H24Br2O4
InChI InChI=1S/C23H24Br2O4/c1-22(2)7-14(26)19(15(27)8-22)18-12-5-11(24)6-13(25)21(12)29-17-10-23(3,4)9-16(28)20(17)18/h5-6,18,26H,7-10H2,1-4H3
InChIKey MKTZLDPJSQVBAV-UHFFFAOYSA-N
Molecular Weight 524.249 g/mol
SMILES OC1=C(C(CC(C1)(C)C)=O)C1C2=C(Oc3c1cc(cc3Br)Br)CC(CC2=O)(C)C
SPLASH splash10-006x-9437850000-22f7d0c294229b27c546
Synonyms 5,7-Dibromo-9-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one 5,7-Dibromo-9-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohex-1-enyl)-3,3-dimethyl-2,3,4,9-tetrahydro-xanthen-1-one 5,7-Dibromo-9-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one 5,7-Dibromo-9-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-3,3-dimethyl-4,9-dihydro-2H-xanthen-1-one
Wiley ID 1446456