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5,5-DIMETHYL-1,1,1-TRIFLUORO-2,4-HEXANEDIONE
SpectraBase Compound ID 7aBEBIWGDC4
InChI InChI=1S/2C8H11F3O2/c2*1-7(2,3)5(12)4-6(13)8(9,10)11/h4H2,1-3H3;4,13H,1-3H3/b;6-4-
InChIKey BRDKLSNJTLTZFU-QQLTZMNSSA-N
Mol Weight 196.17 g/mol
Molecular Formula C8H11F3O2
Exact Mass 196.071114 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IOqQcB8WuPd
Name 5,5-DIMETHYL-1,1,1-TRIFLUORO-2,4-HEXANEDIONE
Source of Sample Eastman Organic Chemicals, Rochester, New York
Boiling Point 68-71C/6mm
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11F3O2
InChI InChI=1S/2C8H11F3O2/c2*1-7(2,3)5(12)4-6(13)8(9,10)11/h4H2,1-3H3;4,13H,1-3H3/b;6-4-
InChIKey BRDKLSNJTLTZFU-QQLTZMNSSA-N
Molecular Weight 196.17
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2,4-HEXANEDIONE, 5,5-DIMETHYL-1,1,1-TRIFLUORO-, 4-HEXEN-3-ONE, 2,2-DIMETHYL-5- HYDROXY-6,6,6-TRIFLUORO-,