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Methyl 3-oxo-5-phenylheptanoate

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Methyl 3-oxo-5-phenylheptanoate
SpectraBase Compound ID 1jtc0y0uq6Q
InChI InChI=1S/C14H18O3/c1-3-11(12-7-5-4-6-8-12)9-13(15)10-14(16)17-2/h4-8,11H,3,9-10H2,1-2H3
InChIKey BQWFLKVHOODGHN-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 Is63ikXcgVu
Name 3-Oxo-5-phenyl-heptanoic acid, methyl ester
CAS Registry Number 102836-26-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-3-11(12-7-5-4-6-8-12)9-13(15)10-14(16)17-2/h4-8,11H,3,9-10H2,1-2H3
InChIKey BQWFLKVHOODGHN-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