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4-Allyl-5-oxo-endo-tricyclo(5.2.1.0/2,6/)deca-3,8-diene-3-carboxylic acid, ethyl ester
SpectraBase Compound ID LbDQfqg976X
InChI InChI=1S/C16H18O3/c1-3-5-11-9-16(15(18)19-4-2)12-7-6-10(8-12)13(16)14(11)17/h3,6-7,9-10,12-13H,1,4-5,8H2,2H3/t10-,12-,13-,16+/m0/s1
InChIKey WMKAWSUWJITVDV-RKOGSIPDSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JjLZvhdUDTk
Name 4-Allyl-5-oxo-endo-tricyclo(5.2.1.0/2,6/)deca-3,8-diene-3-carboxylic acid, ethyl ester
Comments BRUKER WP-60 OR WM-200 SPECTROMETER
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Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-3-5-11-9-16(15(18)19-4-2)12-7-6-10(8-12)13(16)14(11)17/h3,6-7,9-10,12-13H,1,4-5,8H2,2H3/t10-,12-,13-,16+/m0/s1
InChIKey WMKAWSUWJITVDV-RKOGSIPDSA-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