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2,3-DIBROMO-4,5-DIHYDROXYPHENYLETHANOL_SULFATE
SpectraBase Compound ID 7gJmipAwY8N
InChI InChI=1S/C8H8Br2O6S/c9-6-4(1-2-16-17(13,14)15)3-5(11)8(12)7(6)10/h3,11-12H,1-2H2,(H,13,14,15)
InChIKey IVDRMONUQOVGSF-UHFFFAOYSA-N
Mol Weight 392.01 g/mol
Molecular Formula C8H8Br2O6S
Exact Mass 389.840835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E9w4MqhC1Ad
Name 2,3-DIBROMO-4,5-DIHYDROXYPHENYLETHANOL_SULFATE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H8Br2O6S
InChI InChI=1S/C8H8Br2O6S/c9-6-4(1-2-16-17(13,14)15)3-5(11)8(12)7(6)10/h3,11-12H,1-2H2,(H,13,14,15)
InChIKey IVDRMONUQOVGSF-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 392.016 g/mol
Solvent CD3OD
Source File Reference UWMZ18064