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(4E,6E)-2-[(3E)-2-OXO-3-PENTENYL]-4,6-OCTADIENOIC-ACID-METHYLESTER
SpectraBase Compound ID 5txbRjrZYQk
InChI InChI=1S/C14H20O3/c1-4-6-7-8-10-12(14(16)17-3)11-13(15)9-5-2/h4-9,12H,10-11H2,1-3H3/b6-4+,8-7+,9-5+
InChIKey MWMPZIMCLUFZHL-PMOJIRNISA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EHrB7UOxB7I
Name (4E,6E)-2-[(3E)-2-OXO-3-PENTENYL]-4,6-OCTADIENOIC-ACID-METHYLESTER
CAS Registry Number 139759-98-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-4-6-7-8-10-12(14(16)17-3)11-13(15)9-5-2/h4-9,12H,10-11H2,1-3H3/b6-4+,8-7+,9-5+
InChIKey MWMPZIMCLUFZHL-PMOJIRNISA-N
Literature Reference Author S.HUENIG,M.KOCH
Literature Reference Citation CHEM.BER.,125,1635(1992)
Literature Reference DOI 10.1002/cber.19921250719
Molecular Weight 236.311 g/mol
Solvent CDCl3
Source File Reference UWCS9076