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1,1,1,6,6,6-hexafluoro-2,5-dimethyl-hexane-2,5-diol
SpectraBase Compound ID JSWbKZwqZAV
InChI InChI=1S/C8H12F6O2/c1-5(15,7(9,10)11)3-4-6(2,16)8(12,13)14/h15-16H,3-4H2,1-2H3
InChIKey QHGNOXDDLDFIGC-UHFFFAOYSA-N
Mol Weight 254.17 g/mol
Molecular Formula C8H12F6O2
Exact Mass 254.074149 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LmLfk9CFnP3
Name 1,1,1,6,6,6-hexafluoro-2,5-dimethylhexane-2,5-diol
Compound Number 13G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12F6O2
InChI InChI=1S/C8H12F6O2/c1-5(15,7(9,10)11)3-4-6(2,16)8(12,13)14/h15-16H,3-4H2,1-2H3
InChIKey QHGNOXDDLDFIGC-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
Molecular Weight 254.172 g/mol
Solvent CDCl3
Source File Reference UWMS25918