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2-Acetoxy-4-hexenoic acid, butyl ester

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2-Acetoxy-4-hexenoic acid, butyl ester
SpectraBase Compound ID GQaR2fOHPwN
InChI InChI=1S/C12H20O4/c1-4-6-8-11(16-10(3)13)12(14)15-9-7-5-2/h4,6,11H,5,7-9H2,1-3H3/b6-4+
InChIKey XVFFLGKBFKKZOD-GQCTYLIASA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ay91M6AH9mg
Name 2-Acetoxy-4-hexenoic acid, butyl ester
CAS Registry Number 77086-97-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-4-6-8-11(16-10(3)13)12(14)15-9-7-5-2/h4,6,11H,5,7-9H2,1-3H3/b6-4+
InChIKey XVFFLGKBFKKZOD-GQCTYLIASA-N
Literature Reference M. Chmielewski, Pol. J. Chem. 54, 1331 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3