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5-Methyl-3-oxo-6-heptenoic acid, methyl ester
SpectraBase Compound ID 2iJxfIbycbe
InChI InChI=1S/C9H14O3/c1-4-7(2)5-8(10)6-9(11)12-3/h4,7H,1,5-6H2,2-3H3
InChIKey HCRARCOTNWQYHV-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 4ZCX89JLN7v
Name 5-Methyl-3-oxo-6-heptenoic acid, methyl ester
Comments VARIAN EM-390 OR XL-300 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-4-7(2)5-8(10)6-9(11)12-3/h4,7H,1,5-6H2,2-3H3
InChIKey HCRARCOTNWQYHV-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference B.B. Snider, J.J. Patricia, J. Org. Chem. 54, 38 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported