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2-acetyl-3-methyl-but-2-enoic acid ethyl ester
SpectraBase Compound ID FxxmMroCJ3a
InChI InChI=1S/C9H14O3/c1-5-12-9(11)8(6(2)3)7(4)10/h5H2,1-4H3
InChIKey ZTLXZYVSSQOEMA-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JM0XOq8IfoB
Name .alpha.-Isopropylidene-aceto-acetic acid, ethyl ester
CAS Registry Number 35044-52-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-5-12-9(11)8(6(2)3)7(4)10/h5H2,1-4H3
InChIKey ZTLXZYVSSQOEMA-UHFFFAOYSA-N
Instrument Name Bruker AM-200
Literature Reference A.E. De Keijzer, L.H. Koole, H.M.Buck, J. Am. Chem. Soc. 110, 5995 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Toluene-D8