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9H-Xanthen-9-one, 2,7-dichloro-1,3,6-trihydroxy-8-methyl-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

9H-Xanthen-9-one, 2,7-dichloro-1,3,6-trihydroxy-8-methyl-
SpectraBase Compound ID 34OeiFZrmDb
InChI InChI=1S/C14H8Cl2O5/c1-4-9-7(2-5(17)11(4)15)21-8-3-6(18)12(16)14(20)10(8)13(9)19/h2-3,17-18,20H,1H3
InChIKey PNDZPHQVTKKLAZ-UHFFFAOYSA-N
Mol Weight 327.12 g/mol
Molecular Formula C14H8Cl2O5
Exact Mass 325.974879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2CCdHdSVTwp
Name 2,7-Dichloro-8-methyl-1,3,6-trihydroxy-xanthone
CAS Registry Number 22346-57-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H8Cl2O5
InChI InChI=1S/C14H8Cl2O5/c1-4-9-7(2-5(17)11(4)15)21-8-3-6(18)12(16)14(20)10(8)13(9)19/h2-3,17-18,20H,1H3
InChIKey PNDZPHQVTKKLAZ-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference E.G. Sundholm, Acta Chem. Scand. B32, 177 (1978).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6