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7-BROMO-4-HYDROXY-2,3,4,4A-TETRAHYDRO-1H-XANTHEN-1-ONE;CIS-ISOMER
SpectraBase Compound ID 2QveiEkctDD
InChI InChI=1S/C13H11BrO3/c14-8-1-4-12-7(5-8)6-9-10(15)2-3-11(16)13(9)17-12/h1,4-6,11,13,16H,2-3H2/t11-,13-/m0/s1
InChIKey HYAVFCINWTZZJT-AAEUAGOBSA-N
Mol Weight 295.13 g/mol
Molecular Formula C13H11BrO3
Exact Mass 293.989157 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3KmjxnQzQyt
Name 7-BROMO-4-HYDROXY-2,3,4,4A-TETRAHYDRO-1H-XANTHEN-1-ONE;CIS-ISOMER
Compound Number 91
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11BrO3
InChI InChI=1S/C13H11BrO3/c14-8-1-4-12-7(5-8)6-9-10(15)2-3-11(16)13(9)17-12/h1,4-6,11,13,16H,2-3H2/t11-,13-/m0/s1
InChIKey HYAVFCINWTZZJT-AAEUAGOBSA-N
Literature Reference Author A.C.MEISTER,A.ENCINAS,H.SAHIN,E.M.C.SINGER,C.F.NISING,M.NIEG ER,S.BRAESE
Literature Reference Citation EUR.J.ORG.CHEM.,2014,4861(2014)
Literature Reference DOI 10.1002/ejoc.201402083
Molecular Weight 295.133 g/mol
Solvent CDCl3
Source File Reference UWIR19919