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4-[5-tert-Butyl-2-(cyclopropylcarbonyl)phenyl]-1-(4-tert-butylphenyl)butan-1-one
SpectraBase Compound ID G6rmLjzgf8X
InChI InChI=1S/C28H36O2/c1-27(2,3)22-14-12-19(13-15-22)25(29)9-7-8-21-18-23(28(4,5)6)16-17-24(21)26(30)20-10-11-20/h12-18,20H,7-11H2,1-6H3
InChIKey RDQSXOHUWWOQET-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C28H36O2
Exact Mass 404.27153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F4WRosGZOUR
Name 4-[5-TERT.-BUTYL-2-(CYCLOPROPYLCARBONYL)-PHENYL]-1-(4-TERT.-BUTYLPHENYL)-BUTAN-1-ONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36O2
InChI InChI=1S/C28H36O2/c1-27(2,3)22-14-12-19(13-15-22)25(29)9-7-8-21-18-23(28(4,5)6)16-17-24(21)26(30)20-10-11-20/h12-18,20H,7-11H2,1-6H3
InChIKey RDQSXOHUWWOQET-UHFFFAOYSA-N
Literature Reference Author F.AULENTA,A.HOELEMANN,H.U.REISSIG
Literature Reference Citation EUR.J.ORG.CHEM.,1733(2006)
Molecular Weight 404.593 g/mol
Sample ID 31586
Solvent CDCl3