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2-Acetyl-2-methyl-4-phenyl-but-3-yn-oic acid, ethyl ester
SpectraBase Compound ID L4wD0tnrd2P
InChI InChI=1S/C15H16O3/c1-4-18-14(17)15(3,12(2)16)11-10-13-8-6-5-7-9-13/h5-9H,4H2,1-3H3
InChIKey XUXHAPXSCYRDOT-UHFFFAOYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C15H16O3
Exact Mass 244.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GRqvqz88Z8c
Name 2-Acetyl-2-methyl-4-phenyl-but-3-yn-oic acid, ethyl ester
Comments VARIAN XL 100 OR BRUKER MW 400 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H16O3
InChI InChI=1S/C15H16O3/c1-4-18-14(17)15(3,12(2)16)11-10-13-8-6-5-7-9-13/h5-9H,4H2,1-3H3
InChIKey XUXHAPXSCYRDOT-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference M.G. Moloney, J.T. Pinhey, E.G.Roche, J. Chem. Soc. Perkin I 333 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3