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4,4-DIMETHYL-6-PHENYLHEX-5-YN-2-ONE

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4,4-DIMETHYL-6-PHENYLHEX-5-YN-2-ONE
SpectraBase Compound ID LtR5LeAz1xU
InChI InChI=1S/C14H16O/c1-12(15)11-14(2,3)10-9-13-7-5-4-6-8-13/h4-8H,11H2,1-3H3
InChIKey BQNKXHZGMJAQJT-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Y6LoS7hQwY
Name 4,4-DIMETHYL-6-PHENYLHEX-5-YN-2-ONE
Compound Number 6EA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c1-12(15)11-14(2,3)10-9-13-7-5-4-6-8-13/h4-8H,11H2,1-3H3
InChIKey BQNKXHZGMJAQJT-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 200.280 g/mol
Sample ID 34072
Solvent CDCl3