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Methyl 4-oxo-2-{2-[(1E)-propen-1-yl]benzyl}hexanoate
SpectraBase Compound ID JwjddtxsBzR
InChI InChI=1S/C17H22O3/c1-4-8-13-9-6-7-10-14(13)11-15(17(19)20-3)12-16(18)5-2/h4,6-10,15H,5,11-12H2,1-3H3/b8-4+
InChIKey UIPZKNHUOSYATI-XBXARRHUSA-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 3G24DHvcotO
Name METHYL-4-OXO-2-[2-[(1E)-PROPEN-1-YL]-BENZYL]-HEXANOATE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-4-8-13-9-6-7-10-14(13)11-15(17(19)20-3)12-16(18)5-2/h4,6-10,15H,5,11-12H2,1-3H3/b8-4+
InChIKey UIPZKNHUOSYATI-XBXARRHUSA-N
Literature Reference Author J.SAADI,I.BRUEDGAM,H.U.REISSIG
Literature Reference Citation BEIL.J.ORG.CHEM.,6,1229(2010)
Literature Reference DOI 10.3762/bjoc.6.141
Molecular Weight 274.360 g/mol
Solvent CDCl3
Source File Reference UWBT10313