John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4elClVlcIr4 SpectraBase Spectrum ID=2jSLivdPs0u

(accessed ).
5-HYDROXYMETHYL-3-UNDECAFLUOROPENTYLPYRAZOLE
SpectraBase Compound ID 4elClVlcIr4
InChI InChI=1S/C9H5F11N2O/c10-5(11,4-1-3(2-23)21-22-4)6(12,13)7(14,15)8(16,17)9(18,19)20/h1,23H,2H2,(H,21,22)
InChIKey SALFZPCZQZRNJT-UHFFFAOYSA-N
Mol Weight 366.13 g/mol
Molecular Formula C9H5F11N2O
Exact Mass 366.022624 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2jSLivdPs0u
Name 5-HYDROXYMETHYL-3-UNDECAFLUOROPENTYLPYRAZOLE
Compound Number 4BC
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H5F11N2O
InChI InChI=1S/C9H5F11N2O/c10-5(11,4-1-3(2-23)21-22-4)6(12,13)7(14,15)8(16,17)9(18,19)20/h1,23H,2H2,(H,21,22)
InChIKey SALFZPCZQZRNJT-UHFFFAOYSA-N
Literature Reference Author X.Q.TANG,C.M.HU
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1039(1995)
Literature Reference DOI 10.1039/p19950001039
Solvent ACETONE-D6
Source File Reference UWMZ3964
SpectraBase Batch ID 4KROfdo2PZy