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3-PERFLUOROBUTYL-5,6-DIHYDRO-1,4-H-CYCLOPENTA-[D]-PYRAZOLE
SpectraBase Compound ID CcBSKiLPvgI
InChI InChI=1S/C10H7F9N2/c11-7(12,6-4-2-1-3-5(4)20-21-6)8(13,14)9(15,16)10(17,18)19/h1-3H2,(H,20,21)
InChIKey SQZPNJMZPCDRSW-UHFFFAOYSA-N
Mol Weight 326.17 g/mol
Molecular Formula C10H7F9N2
Exact Mass 326.046552 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DvGzW9uUA4y
Name 3-PERFLUOROBUTYL-5,6-DIHYDRO-1,4-H-CYCLOPENTA-[D]-PYRAZOLE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H7F9N2
InChI InChI=1S/C10H7F9N2/c11-7(12,6-4-2-1-3-5(4)20-21-6)8(13,14)9(15,16)10(17,18)19/h1-3H2,(H,20,21)
InChIKey SQZPNJMZPCDRSW-UHFFFAOYSA-N
Literature Reference Author D.V.SEVENARD,O.G.KHOMUTOV,M.I.KODESS,K.I.PASHKEVICH,I.LOOP,E .LORK,G.V.ROESCHENT
Literature Reference Citation CAN.J.CHEM.,79,183(2001)
Literature Reference DOI 10.1139/cjc-79-2-183
Solvent CDCl3
Source File Reference UWSI16021