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5-Oxo-endo-tricyclo(5.2.1.0/2,6/)deca-3,8-diene-2-carboxylic acid, ethyl ester
SpectraBase Compound ID 3BevMTDfa4K
InChI InChI=1S/C13H14O3/c1-2-16-12(15)13-6-5-10(14)11(13)8-3-4-9(13)7-8/h3-6,8-9,11H,2,7H2,1H3/t8-,9-,11-,13+/m0/s1
InChIKey ZYKKBCZKDGUTCM-LKAMGYQZSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D5RXx3eLcu3
Name 5-Oxo-endo-tricyclo(5.2.1.0/2,6/)deca-3,8-diene-2-carboxylic acid, ethyl ester
Comments BRUKER WP-60 OR WM-200 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-2-16-12(15)13-6-5-10(14)11(13)8-3-4-9(13)7-8/h3-6,8-9,11H,2,7H2,1H3/t8-,9-,11-,13+/m0/s1
InChIKey ZYKKBCZKDGUTCM-LKAMGYQZSA-N
Instrument Name see comment
Literature Reference J.H. Lange, A.J. Klunder, B. Zwanenburg, Tetrahedron 47, 1495 (1991).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3