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(2S,4AS,9R,9AS)-2,7-DIBROMO-4A-BROMOMETHYL-1,1-DIMETHYL-2,3,4,4A,9,9A-HEXAHYDRO-1H-XANTHEN-9-OL;9-BETA-HYDROXYTRIBROMOCACOXANTHENE

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(2S,4AS,9R,9AS)-2,7-DIBROMO-4A-BROMOMETHYL-1,1-DIMETHYL-2,3,4,4A,9,9A-HEXAHYDRO-1H-XANTHEN-9-OL;9-BETA-HYDROXYTRIBROMOCACOXANTHENE
SpectraBase Compound ID 46658YVjVHN
InChI InChI=1S/C16H19Br3O2/c1-15(2)12(19)5-6-16(8-17)14(15)13(20)10-7-9(18)3-4-11(10)21-16/h3-4,7,12-14,20H,5-6,8H2,1-2H3/t12-,13-,14-,16+/m0/s1
InChIKey RAYCXYWICCNQQJ-RZLSGREXSA-N
Mol Weight 483.04 g/mol
Molecular Formula C16H19Br3O2
Exact Mass 479.893519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E4qtq3TrAJE
Name (2S,4AS,9R,9AS)-2,7-DIBROMO-4A-BROMOMETHYL-1,1-DIMETHYL-2,3,4,4A,9,9A-HEXAHYDRO-1H-XANTHEN-9-OL;9-BETA-HYDROXYTRIBROMOCACOXANTHENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H19Br3O2
InChI InChI=1S/C16H19Br3O2/c1-15(2)12(19)5-6-16(8-17)14(15)13(20)10-7-9(18)3-4-11(10)21-16/h3-4,7,12-14,20H,5-6,8H2,1-2H3/t12-,13-,14-,16+/m0/s1
InChIKey RAYCXYWICCNQQJ-RZLSGREXSA-N
Literature Reference Author D.K.L.BALI,V.LIOKAS,M.J.GARSON,D.J.FAULKNER
Literature Reference Citation AUSTR.J.CHEM.,43,2009(1990)
Literature Reference DOI 10.1071/ch9902009
Molecular Weight 483.038 g/mol
Solvent CDCl3
Source File Reference UWED9562