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3-BROMO-2-(2,3-DIBROMO-4,5-DIHYDROXYBENZYL)-4,5-DIHYDROXYPHENYLETHANOL_SULFATE
SpectraBase Compound ID I9NnvQuQdHm
InChI InChI=1S/C15H13Br3O8S/c16-11-7(5-10(20)15(22)13(11)18)3-8-6(1-2-26-27(23,24)25)4-9(19)14(21)12(8)17/h4-5,19-22H,1-3H2,(H,23,24,25)
InChIKey RSHSGTXAJDPDPI-UHFFFAOYSA-N
Mol Weight 593.03 g/mol
Molecular Formula C15H13Br3O8S
Exact Mass 589.788128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7x49M4iWcoa
Name 3-BROMO-2-(2,3-DIBROMO-4,5-DIHYDROXYBENZYL)-4,5-DIHYDROXYPHENYLETHANOL_SULFATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H13Br3O8S
InChI InChI=1S/C15H13Br3O8S/c16-11-7(5-10(20)15(22)13(11)18)3-8-6(1-2-26-27(23,24)25)4-9(19)14(21)12(8)17/h4-5,19-22H,1-3H2,(H,23,24,25)
InChIKey RSHSGTXAJDPDPI-UHFFFAOYSA-N
Literature Reference Author M.MA,J.ZHAO,S.WANG,S.LI,Y.YANG,J.SHI,X.FAN,L.HE
Literature Reference Citation J.NAT.PROD.,69,206(2006)
Literature Reference DOI 10.1021/np050343g
Molecular Weight 593.035 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ18061