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2-EXO-(2'-CHLORO-3'-FLUORO-5'-PYRIDINYL)-7-AZABICYCLO-[2.2.1]-HEPTANE
SpectraBase Compound ID J4aBmOLayl0
InChI InChI=1S/C11H12ClFN2/c12-11-9(13)3-6(5-14-11)8-4-7-1-2-10(8)15-7/h3,5,7-8,10,15H,1-2,4H2/t7-,8-,10-/m1/s1
InChIKey PKAQUVZVSSGSES-NQMVMOMDSA-N
Mol Weight 226.68 g/mol
Molecular Formula C11H12ClFN2
Exact Mass 226.067304 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XGHTL7rdPr
Name 2-EXO-(2'-CHLORO-3'-FLUORO-5'-PYRIDINYL)-7-AZABICYCLO-[2.2.1]-HEPTANE
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12ClFN2
InChI InChI=1S/C11H12ClFN2/c12-11-9(13)3-6(5-14-11)8-4-7-1-2-10(8)15-7/h3,5,7-8,10,15H,1-2,4H2/t7-,8-,10-/m1/s1
InChIKey PKAQUVZVSSGSES-NQMVMOMDSA-N
Literature Reference Author F.I.CARROLL,J.R.LEE,H.A.NAVARRO,W.MA,L.E.BRIEADDY,P.ABRAHAM, M.I.DAMAJ,B.R.MARTIN
Literature Reference Citation J.MED.CHEM.,45,4755(2002)
Literature Reference DOI 10.1021/jm0202268
Molecular Weight 226.681 g/mol
Sample ID 65107
Solvent CDCl3