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Methyl aceto acetate
SpectraBase Compound ID IOQkMBtG808
InChI InChI=1S/C5H8O3/c1-4(6)3-5(7)8-2/h3H2,1-2H3
InChIKey WRQNANDWMGAFTP-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 19vM3ehZiQG
Name Acetoacetic acid, methyl ester
CAS Registry Number 105-45-3
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/h3H2,1-2H3
InChIKey WRQNANDWMGAFTP-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference V. Machacek, V. Sterba, A. Lycka, J. Chem. Soc. Perkin II 355 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6