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1-(Oct-1-ynyl)-2-oxo-cyclopentanecarboxylic acid, ethyl ester
SpectraBase Compound ID 6jDJ0pbu4XL
InChI InChI=1S/C16H24O3/c1-3-5-6-7-8-9-12-16(15(18)19-4-2)13-10-11-14(16)17/h3-8,10-11,13H2,1-2H3
InChIKey JDPPKJXFPBHWFE-UHFFFAOYSA-N
Mol Weight 264.36 g/mol
Molecular Formula C16H24O3
Exact Mass 264.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDRrbH4ERm0
Name 1-(Oct-1-ynyl)-2-oxo-cyclopentanecarboxylic acid, ethyl ester
Comments VARIAN XL 100 OR BRUKER MW 400 SPECTROMETER, REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H24O3
InChI InChI=1S/C16H24O3/c1-3-5-6-7-8-9-12-16(15(18)19-4-2)13-10-11-14(16)17/h3-8,10-11,13H2,1-2H3
InChIKey JDPPKJXFPBHWFE-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 Benzene-D6