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1-(4'-CARBOMETHOXYPHENYL)-3-(4''-METHYLPHENYL)-1,3-PROPANEDIONE
SpectraBase Compound ID 22A1UlkL0sB
InChI InChI=1S/C18H16O4/c1-12-3-5-13(6-4-12)16(19)11-17(20)14-7-9-15(10-8-14)18(21)22-2/h3-10H,11H2,1-2H3
InChIKey VXPJBBDLRXKJPU-UHFFFAOYSA-N
Mol Weight 296.32 g/mol
Molecular Formula C18H16O4
Exact Mass 296.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZuYVzyJPrm
Name 1-(4'-CARBOMETHOXYPHENYL)-3-(4''-METHYLPHENYL)-1,3-PROPANEDIONE
Compound Number 4J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16O4
InChI InChI=1S/C18H16O4/c1-12-3-5-13(6-4-12)16(19)11-17(20)14-7-9-15(10-8-14)18(21)22-2/h3-10H,11H2,1-2H3
InChIKey VXPJBBDLRXKJPU-UHFFFAOYSA-N
Literature Reference Author W.ADAM,H.M.HARRER,W.M.NAU,K.PETERS
Literature Reference Citation J.ORG.CHEM.,59,3786(1994)
Literature Reference DOI 10.1021/jo00093a010
Molecular Weight 296.323 g/mol
Solvent CDCl3
Source File Reference UWCP6899