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trans-2-N-Heptyl-3-oxo-cyclopentane-carboxylic acid
SpectraBase Compound ID AXMe26QVzn2
InChI InChI=1S/C13H22O3/c1-2-3-4-5-6-7-10-11(13(15)16)8-9-12(10)14/h10-11H,2-9H2,1H3,(H,15,16)
InChIKey DWLYHFUPXDSENT-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E7qWotzDZxP
Name trans-2-N-Heptyl-3-oxo-cyclopentane-carboxylic acid
Comments BRUKER WP-60 OR WM-200 SPECTROMETER, SHIFTCORRECTION: +0.3 PPM - REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-2-3-4-5-6-7-10-11(13(15)16)8-9-12(10)14/h10-11H,2-9H2,1H3,(H,15,16)
InChIKey DWLYHFUPXDSENT-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference J.H. Lange, A.J. Klunder, B. Zwanenburg, Tetrahedron 47, 1509 (1991).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3