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3-(4-METHOXY-2-METHYLPHENYL)-CYCLOPENTANONE

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3-(4-METHOXY-2-METHYLPHENYL)-CYCLOPENTANONE
SpectraBase Compound ID 9c5gcjFkHau
InChI InChI=1S/C13H16O2/c1-9-7-12(15-2)5-6-13(9)10-3-4-11(14)8-10/h5-7,10H,3-4,8H2,1-2H3
InChIKey SMWJRXXMBHVYOK-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HXKbAcQFONa
Name 3-(4-METHOXY-2-METHYLPHENYL)-CYCLOPENTANONE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-9-7-12(15-2)5-6-13(9)10-3-4-11(14)8-10/h5-7,10H,3-4,8H2,1-2H3
InChIKey SMWJRXXMBHVYOK-UHFFFAOYSA-N
Literature Reference Author P.L.SMITH,J.M.KEANE,S.E.SHANKMAN,M.D.CHORIDA,W.D.HARMAN
Literature Reference Citation J.AM.CHEM.SOC.,126,15543(2004)
Literature Reference DOI 10.1021/ja047054j
Molecular Weight 204.269 g/mol
Solvent ACETONE-D6
Source File Reference UWLU34817