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9-CHLORO-8-HYDROXY-8,9-DEOXYASPYRONE
SpectraBase Compound ID 22xPRbM1YVx
InChI InChI=1S/C9H13ClO4/c1-4(10)8(12)6-3-7(11)5(2)14-9(6)13/h3-5,7-8,11-12H,1-2H3/t4?,5-,7+,8?/m0/s1
InChIKey RFRJSDLXLVSACH-XVMLKPHDSA-N
Mol Weight 220.65 g/mol
Molecular Formula C9H13ClO4
Exact Mass 220.050237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EY7rapm3A7s
Name 9-CHLORO-8-HYDROXY-8,9-DEOXYASPYRONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13ClO4
InChI InChI=1S/C9H13ClO4/c1-4(10)8(12)6-3-7(11)5(2)14-9(6)13/h3-5,7-8,11-12H,1-2H3/t4?,5-,7+,8?/m0/s1
InChIKey RFRJSDLXLVSACH-XVMLKPHDSA-N
Literature Reference Author M.NAMIKOSHI,R.NEGISHI,H.NAGAI,A.DMITRENOK,H.KOBAYASHI
Literature Reference Citation J.ANTIBIOTICS,56,755(2003)
Literature Reference DOI 10.7164/antibiotics.56.755
Molecular Weight 220.653 g/mol
Solvent CDCl3:CD3OD=85:15
Source File Reference UWSP728