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Methyl 3-oxo-4-phenylheptanoate

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Methyl 3-oxo-4-phenylheptanoate
SpectraBase Compound ID 6HesyzcbRcH
InChI InChI=1S/C14H18O3/c1-3-7-12(11-8-5-4-6-9-11)13(15)10-14(16)17-2/h4-6,8-9,12H,3,7,10H2,1-2H3
InChIKey KCZJIRKBJGZKLI-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AxiW9RtBRIf
Name 3-Oxo-4-phenyl-heptanoic acid, methyl ester
CAS Registry Number 104620-35-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-3-7-12(11-8-5-4-6-9-11)13(15)10-14(16)17-2/h4-6,8-9,12H,3,7,10H2,1-2H3
InChIKey KCZJIRKBJGZKLI-UHFFFAOYSA-N
Literature Reference D.F. Taber, R.E. Ruckle, J. Am. Chem. Soc. 108, 7686 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported