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METHYL_ACETOACETATE;ENOL_FORM
SpectraBase Compound ID IuyXTQYMmRQ
InChI InChI=1S/C5H8O3/c1-4(6)3-5(7)8-2/h3,6H,1-2H3/b4-3-
InChIKey DHVOJYDALVUWPZ-ARJAWSKDSA-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 7YU30CUSD1L
Name Methyl acetoacetate (cis-enol form)
CAS Registry Number 4525-25-1
Comments ENOL FORM, FROM SHAPETKO
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H8O3
InChI InChI=1S/C5H8O3/c1-4(6)3-5(7)8-2/h3,6H,1-2H3/b4-3-
InChIKey DHVOJYDALVUWPZ-ARJAWSKDSA-N
Literature Reference A.R. Katritzky, P. Barczynski, J. Chem. Soc. Perkin II 969 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported