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3-(TRIFLUOROMETHYL)-BICYCLO-[1.1.1]-PENTANE-1-CARBOXYLIC-ACID;X=F,Y=C6H5
SpectraBase Compound ID D01S340Hb08
InChI InChI=1S/C7H7F3O2/c8-7(9,10)6-1-5(2-6,3-6)4(11)12/h1-3H2,(H,11,12)
InChIKey CGISBZCYXGUFNK-UHFFFAOYSA-N
Mol Weight 180.13 g/mol
Molecular Formula C7H7F3O2
Exact Mass 180.039814 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AyYgptGeaSQ
Name 4-CARBOXYL-BICYCLO-[1.1.1]-PENT-1-YL_TRIFLUORIDE
Compound Number 1B_(X=COOH)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7F3O2
InChI InChI=1S/C7H7F3O2/c8-7(9,10)6-1-5(2-6,3-6)4(11)12/h1-3H2,(H,11,12)
InChIKey CGISBZCYXGUFNK-UHFFFAOYSA-N
Literature Reference Author W.ADCOCK,J.E.PERALTA,R.H.CONTRERAS
Literature Reference Citation MAGN.RES.CHEM.,41,503(2003)
Literature Reference DOI 10.1002/mrc.1202
Solvent CDCl3
Source File Reference UWMZ20214