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6-Phenylhex-5-yn-2-one

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6-Phenylhex-5-yn-2-one
SpectraBase Compound ID 5zSIxtEngzj
InChI InChI=1S/C12H12O/c1-11(13)7-5-6-10-12-8-3-2-4-9-12/h2-4,8-9H,5,7H2,1H3
InChIKey PIKFFDHAWAQMQK-UHFFFAOYSA-N
Mol Weight 172.23 g/mol
Molecular Formula C12H12O
Exact Mass 172.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJIJTWYf3j7
Name 6-PHENYLHEX-5-YN-2-ONE
Compound Number 6JA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O
InChI InChI=1S/C12H12O/c1-11(13)7-5-6-10-12-8-3-2-4-9-12/h2-4,8-9H,5,7H2,1H3
InChIKey PIKFFDHAWAQMQK-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 172.227 g/mol
Sample ID 34081
Solvent CDCl3