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ALPHA-DIKETONE-5-HYDROXY-2,3-PENTANEDIONE
SpectraBase Compound ID LTWCOoCfj3D
InChI InChI=1S/C5H8O3/c1-4(7)5(8)2-3-6/h6H,2-3H2,1H3
InChIKey LKLKMCUVBQDYFU-UHFFFAOYSA-N
Mol Weight 116.12 g/mol
Molecular Formula C5H8O3
Exact Mass 116.047344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BkqyT18EuQb
Name ALPHA-DIKETONE-5-HYDROXY-2,3-PENTANEDIONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H8O3
InChI InChI=1S/C5H8O3/c1-4(7)5(8)2-3-6/h6H,2-3H2,1H3
InChIKey LKLKMCUVBQDYFU-UHFFFAOYSA-N
Literature Reference Author M.W.BERNART,W.H.GERWICK,E.E.CORCORAN,A.Y.LEE,J.CLARDY
Literature Reference Citation PHYTOCHEM.,31,1273(1992)
Literature Reference DOI 10.1016/0031-9422(92)80276-K
Molecular Weight 116.117 g/mol
Solvent CDCl3
Source File Reference UWVN5121