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4,7-Dihydro-7-oxo-6-phenyloxepin-2-carboxylic acid-methylester
SpectraBase Compound ID 1JkF6EstTIG
InChI InChI=1S/C14H12O4/c1-17-14(16)12-9-5-8-11(13(15)18-12)10-6-3-2-4-7-10/h2-4,6-9H,5H2,1H3
InChIKey AKBGUVCRKKYNOA-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C14H12O4
Exact Mass 244.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KMOvgLGZvfp
Name 4,7-DIHYDRO-7-OXO-6-PHENYLOXEPIN-2-CARBOXYLIC-ACID-METHYLESTER
CAS Registry Number 115410-98-5
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12O4
InChI InChI=1S/C14H12O4/c1-17-14(16)12-9-5-8-11(13(15)18-12)10-6-3-2-4-7-10/h2-4,6-9H,5H2,1H3
InChIKey AKBGUVCRKKYNOA-UHFFFAOYSA-N
Literature Reference Author M.CHRISTL,U.LANZENDOERFER,M.M.GROETSCH,E.DITTERICH,J.HEGMANN
Literature Reference Citation CHEM.BER.,123,2031(1990)
Literature Reference DOI 10.1002/cber.19901231014
Molecular Weight 244.247 g/mol
Solvent CDCl3
Source File Reference UWCS14648