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3-Chloro-2,5,6,8-tetrahydroxy-1,4-naphthoquinone
SpectraBase Compound ID 1MGhszJwMib
InChI InChI=1S/C10H5ClO6/c11-6-8(15)5-4(9(16)10(6)17)2(12)1-3(13)7(5)14/h1,12-14,17H
InChIKey YPOXQUDCHQWVFH-UHFFFAOYSA-N
Mol Weight 256.6 g/mol
Molecular Formula C10H5ClO6
Exact Mass 255.977466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BWbcmxWABSz
Name 3-CHLORO-2,5,6,8-TETRAHYDROXY-1,4-NAPHTHOQUINONE
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H5ClO6
InChI InChI=1S/C10H5ClO6/c11-6-8(15)5-4(9(16)10(6)17)2(12)1-3(13)7(5)14/h1,12-14,17H
InChIKey YPOXQUDCHQWVFH-UHFFFAOYSA-N
Literature Reference Author N.D.POKHILO,M.I.SHUVALOVA,M.V.LEBEDKO,G.I.SOPELNYAK,A.Y.YAKU BOVSKAYA,N.P.MISCHEN
Literature Reference Citation J.NAT.PROD.,69,1125(2006)
Literature Reference DOI 10.1021/np0502185
Molecular Weight 256.599 g/mol
Solvent CDCl3
Source File Reference UWMZ15674