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2-(1-CHLORO-1-PROPENYL)-4,5-DIHYDROXYCYCLOPENT-2-ENONE;CPDHC
SpectraBase Compound ID 9XHz5CpreiY
InChI InChI=1S/C8H9ClO3/c1-2-5(9)4-3-6(10)8(12)7(4)11/h2-3,6,8,10,12H,1H3/b5-2-/t6-,8+/m1/s1
InChIKey VLJLBZXEKHNAQP-BCOZSSAFSA-N
Mol Weight 188.61 g/mol
Molecular Formula C8H9ClO3
Exact Mass 188.024022 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ig9dg1U7OyE
Name 2-(1-CHLORO-1-PROPENYL)-4,5-DIHYDROXYCYCLOPENT-2-ENONE;CPDHC
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9ClO3
InChI InChI=1S/C8H9ClO3/c1-2-5(9)4-3-6(10)8(12)7(4)11/h2-3,6,8,10,12H,1H3/b5-2-/t6-,8+/m1/s1
InChIKey VLJLBZXEKHNAQP-BCOZSSAFSA-N
Literature Reference Author M.WEIDLER,J.RETHER,T.ANKE,G.ERKEL,O.STERNER
Literature Reference Citation J.ANTIBIOTICS,54,679(2001)
Literature Reference DOI 10.7164/antibiotics.54.679
Molecular Weight 188.611 g/mol
Solvent CDCl3:CD3OD=9:1
Source File Reference UWSI2042