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(3E,1'R*,5'S*)-4-(5'-tert-Butyl-2',2'-dimethylcyclopentyl)but-3-en-2-one
SpectraBase Compound ID 4L4U4xsXLvc
InChI InChI=1S/C15H26O/c1-11(16)7-8-13-12(14(2,3)4)9-10-15(13,5)6/h7-8,12-13H,9-10H2,1-6H3/b8-7+/t12-,13+/m0/s1
InChIKey QOXCDHHBGKCDLK-AHYBDNRGSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HGmxLxTmJy
Name [(3E),1'R*,5'S*]-4-(5'-TERT.-BUTYL-2',2'-DIMETHYL-CYCLOPENTYL)-BUT-3-EN-2-ONE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H26O
InChI InChI=1S/C15H26O/c1-11(16)7-8-13-12(14(2,3)4)9-10-15(13,5)6/h7-8,12-13H,9-10H2,1-6H3/b8-7+/t12-,13+/m0/s1
InChIKey QOXCDHHBGKCDLK-AHYBDNRGSA-N
Literature Reference Author P.KRAFT,S.JORDI,N.DENIZOT,I.FELKER
Literature Reference Citation EUR.J.ORG.CHEM.,2014,554(2014)
Literature Reference DOI 10.1002/ejoc.201301107
Molecular Weight 222.371 g/mol
Solvent CDCl3
Source File Reference UWIR18196