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3-tert-Butyl-4-fluoro-5-phenyl-1H-pyrazole
SpectraBase Compound ID LwNV9vwxaUn
InChI InChI=1S/C13H15FN2/c1-13(2,3)12-10(14)11(15-16-12)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,15,16)
InChIKey UWONYIKLYPQNAL-UHFFFAOYSA-N
Mol Weight 218.28 g/mol
Molecular Formula C13H15FN2
Exact Mass 218.121927 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 98DXhFarND4
Name 3-TERT.-BUTYL-4-FLUORO-5-PHENYL-1H-PYRAZOLE
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15FN2
InChI InChI=1S/C13H15FN2/c1-13(2,3)12-10(14)11(15-16-12)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,15,16)
InChIKey UWONYIKLYPQNAL-UHFFFAOYSA-N
Literature Reference Author J.R.BREEN,G.SANDFORD,D.S.YUFIT,J.A.K.HOWARD,J.FRAY,B.PATEL
Literature Reference Citation BEIL.J.ORG.CHEM.,7,1048(2011)
Literature Reference DOI 10.3762/bjoc.7.120
Solvent CDCl3
Source File Reference UWBT9698