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LAHORENOIC_ACIDB;METHYL_6-(2-((E)-3-OXOBUT-1-ENYL)-PHENYL)-HEXANOATE
SpectraBase Compound ID Iz7qrm0esSD
InChI InChI=1S/C17H22O3/c1-14(18)12-13-16-10-7-6-9-15(16)8-4-3-5-11-17(19)20-2/h6-7,9-10,12-13H,3-5,8,11H2,1-2H3/b13-12+
InChIKey BYTVKDVESHEQOK-OUKQBFOZSA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CLeLavehmwj
Name LAHORENOIC_ACIDB;METHYL_6-(2-((E)-3-OXOBUT-1-ENYL)-PHENYL)-HEXANOATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-14(18)12-13-16-10-7-6-9-15(16)8-4-3-5-11-17(19)20-2/h6-7,9-10,12-13H,3-5,8,11H2,1-2H3/b13-12+
InChIKey BYTVKDVESHEQOK-OUKQBFOZSA-N
Literature Reference Author S.MEHNAZ,R.S.Z.SALEEM,B.YAMEEN,I.PIANET,G.SCHNAKENBURG,H.PIE TRASZKIEWICZ,F.VALER
Literature Reference Citation J.NAT.PROD.,76,135(2013)
Literature Reference DOI 10.1021/np3005166
Molecular Weight 274.360 g/mol
Sample ID 42015
Solvent CD3OD