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BENZYL-2-(4,4-DIMETHYL-2-OXOCYCLOPENTYL)-ACETATE
SpectraBase Compound ID 3DOUrsaf8Pi
InChI InChI=1S/C16H20O3/c1-16(2)9-13(14(17)10-16)8-15(18)19-11-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3
InChIKey CIQVJLMDBNNPOC-UHFFFAOYSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IruEwdVcH6G
Name BENZYL-2-(4,4-DIMETHYL-2-OXOCYCLOPENTYL)-ACETATE
Compound Number 2B'
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-16(2)9-13(14(17)10-16)8-15(18)19-11-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3
InChIKey CIQVJLMDBNNPOC-UHFFFAOYSA-N
Literature Reference Author I.RYU,S.KREIMERMAN,F.ARAKI,S.NISHITANI,Y.ODERAOTOSHI,S.MINAK ATA,M.KOMATSU
Literature Reference Citation J.AM.CHEM.SOC.,124,3812(2002)
Literature Reference DOI 10.1021/ja017315e
Molecular Weight 260.333 g/mol
Sample ID 33560
Solvent CDCl3