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1,1,1,6,6,6-hexafluoro-5-hydroxy-5-methylhexan-2-one
SpectraBase Compound ID 5PUQTupZArG
InChI InChI=1S/C7H8F6O2/c1-5(15,7(11,12)13)3-2-4(14)6(8,9)10/h15H,2-3H2,1H3
InChIKey VVDXSJBTEANSMS-UHFFFAOYSA-N
Mol Weight 238.13 g/mol
Molecular Formula C7H8F6O2
Exact Mass 238.042848 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3zXBUpHrKxo
Name 1,1,1,6,6,6-hexafluoro-5-hydroxy-5-methylhexan-2-one
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H8F6O2
InChI InChI=1S/C7H8F6O2/c1-5(15,7(11,12)13)3-2-4(14)6(8,9)10/h15H,2-3H2,1H3
InChIKey VVDXSJBTEANSMS-UHFFFAOYSA-N
Literature Reference Author R.P.SINGH,J.M.LEITCH,B.TWAMLEY,J.M.SHREEVE
Literature Reference Citation J.ORG.CHEM.,66,1436(2001)
Literature Reference DOI 10.1021/jo0057304
Solvent CDCl3
Source File Reference UWMS25924