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4-BUTYL-5-FLUORO-1-ISOPROPYL-3-PHENYLPYRAZOLE

View entire compound with spectra: 3 NMR, and 1 MS (GC)

4-BUTYL-5-FLUORO-1-ISOPROPYL-3-PHENYLPYRAZOLE
SpectraBase Compound ID 8XGN66E6HJq
InChI InChI=1S/C16H21FN2/c1-4-5-11-14-15(13-9-7-6-8-10-13)18-19(12(2)3)16(14)17/h6-10,12H,4-5,11H2,1-3H3
InChIKey PIEKNCCBHUYZBP-UHFFFAOYSA-N
Mol Weight 260.36 g/mol
Molecular Formula C16H21FN2
Exact Mass 260.168877 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8yhvUUzUVlj
Name 4-BUTYL-5-FLUORO-1-ISOPROPYL-3-PHENYLPYRAZOLE
Compound Number 2I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21FN2
InChI InChI=1S/C16H21FN2/c1-4-5-11-14-15(13-9-7-6-8-10-13)18-19(12(2)3)16(14)17/h6-10,12H,4-5,11H2,1-3H3
InChIKey PIEKNCCBHUYZBP-UHFFFAOYSA-N
Literature Reference Author J.ICHIKAWA,M.KOBAYASHI,Y.NODA,N.YOKOTA,K.AMANO,T.MINAMI
Literature Reference Citation J.ORG.CHEM.,61,2763(1996)
Literature Reference DOI 10.1021/jo951814e
Solvent CDCl3
Source File Reference UWSP10082