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4-METHYL-4,6-DIPHENYLHEX-5-YN-2-ONE

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4-METHYL-4,6-DIPHENYLHEX-5-YN-2-ONE
SpectraBase Compound ID CJ4H6RyyIna
InChI InChI=1S/C19H18O/c1-16(20)15-19(2,18-11-7-4-8-12-18)14-13-17-9-5-3-6-10-17/h3-12H,15H2,1-2H3
InChIKey OWWSVNVYGHKETJ-UHFFFAOYSA-N
Mol Weight 262.35 g/mol
Molecular Formula C19H18O
Exact Mass 262.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wI5K4it5Vh
Name 4-METHYL-4,6-DIPHENYLHEX-5-YN-2-ONE
Compound Number 6AA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18O
InChI InChI=1S/C19H18O/c1-16(20)15-19(2,18-11-7-4-8-12-18)14-13-17-9-5-3-6-10-17/h3-12H,15H2,1-2H3
InChIKey OWWSVNVYGHKETJ-UHFFFAOYSA-N
Literature Reference Author I.MATSUDA,K.I.KOMORI,K.ITOH
Literature Reference Citation J.AM.CHEM.SOC.,124,9072(2002)
Literature Reference DOI 10.1021/ja0264089
Molecular Weight 262.351 g/mol
Sample ID 34064
Solvent CDCl3