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1-(1,1-DIMETHYLETHYL)-3-(FUR-2-YL)-5-TRIFLUOROMETHYL-1H-PYRAZOLE
SpectraBase Compound ID BUCcnrEEvc9
InChI InChI=1S/C12H13F3N2O/c1-11(2,3)17-10(12(13,14)15)7-8(16-17)9-5-4-6-18-9/h4-7H,1-3H3
InChIKey GQFJCBALJALBAH-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C12H13F3N2O
Exact Mass 258.097998 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5vh43pxd7OG
Name 1-(1,1-DIMETHYLETHYL)-3-(FUR-2-YL)-5-TRIFLUOROMETHYL-1H-PYRAZOLE
Compound Number 4J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13F3N2O
InChI InChI=1S/C12H13F3N2O/c1-11(2,3)17-10(12(13,14)15)7-8(16-17)9-5-4-6-18-9/h4-7H,1-3H3
InChIKey GQFJCBALJALBAH-UHFFFAOYSA-N
Literature Reference Author M.A.P.MARTINS,M.R.B.MARZARI,C.P.FRIZZO,M.ZANATTA,L.BURIOL,V. P.ANDRADE,N.ZANATTA,
Literature Reference Citation EUR.J.ORG.CHEM.,2012,7112(2012)
Literature Reference DOI 10.1002/ejoc.201201111
Molecular Weight 258.243 g/mol
Solvent CDCl3
Source File Reference UWLU83535