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4-CHLORO-1,3-DIHYDROXY-2-METHYL-XANTHONE
SpectraBase Compound ID JSyyPVItrlC
InChI InChI=1S/C14H9ClO4/c1-6-11(16)9-13(18)7-4-2-3-5-8(7)19-14(9)10(15)12(6)17/h2-5,16-17H,1H3
InChIKey AWNIUBDOEINZQP-UHFFFAOYSA-N
Mol Weight 276.68 g/mol
Molecular Formula C14H9ClO4
Exact Mass 276.018936 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ATxKmDOpsyi
Name 4-CHLORO-1,3-DIHYDROXY-2-METHYL-XANTHONE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H9ClO4
InChI InChI=1S/C14H9ClO4/c1-6-11(16)9-13(18)7-4-2-3-5-8(7)19-14(9)10(15)12(6)17/h2-5,16-17H,1H3
InChIKey AWNIUBDOEINZQP-UHFFFAOYSA-N
Literature Reference Author E.G.R.FERNANDES,A.M.S.SILVA,J.A.S.CAVALEIRO,F.M.SILVA,M.F.M. BORGES,M.M.M.PINTO
Literature Reference Citation MAGN.RES.CHEM.,36,305(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199804)36:4<305::aid-omr193>3.0.co;2-n
Molecular Weight 276.676 g/mol
Solvent DMSO-D6
Source File Reference UWRU1596