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4,4,4-Trifluoro-3-hydroxy-1-(4-methylphenyl)-1-butanone

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4,4,4-Trifluoro-3-hydroxy-1-(4-methylphenyl)-1-butanone
SpectraBase Compound ID 1NVpv0eNECt
InChI InChI=1S/C11H11F3O2/c1-7-2-4-8(5-3-7)9(15)6-10(16)11(12,13)14/h2-5,10,16H,6H2,1H3
InChIKey KGNOSHVLNFQZFL-UHFFFAOYSA-N
Mol Weight 232.2 g/mol
Molecular Formula C11H11F3O2
Exact Mass 232.071114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ISbeuSImmu
Name 4,4,4-TRIFLUORO-3-HYDROXY-1-(4-METHYLPHENYL)-1-BUTANONE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11F3O2
InChI InChI=1S/C11H11F3O2/c1-7-2-4-8(5-3-7)9(15)6-10(16)11(12,13)14/h2-5,10,16H,6H2,1H3
InChIKey KGNOSHVLNFQZFL-UHFFFAOYSA-N
Literature Reference Author K.FUNABIKI,K.MATSUNAGA,M.NOJIRI,W.HASHIMOTO,H.YAMAMOTO,K.SHI BATA,M.MATSUI
Literature Reference Citation J.ORG.CHEM.,68,2853(2003)
Literature Reference DOI 10.1021/jo026697j
Molecular Weight 232.202 g/mol
Solvent CDCl3
Source File Reference UWSI22702