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N-FORMYL-2-EXO-(2-CHLORO-5-PYRIDYL)-7-AZABICYCLO-[2.2.1]-HEPTANE;ROTAMER-#1
SpectraBase Compound ID 27ToDcBxZyZ
InChI InChI=1S/C12H13ClN2O/c13-12-4-1-8(6-14-12)10-5-9-2-3-11(10)15(9)7-16/h1,4,6-7,9-11H,2-3,5H2/t9-,10-,11+/m1/s1
InChIKey ZRCWLLKGTSBWQC-MXWKQRLJSA-N
Mol Weight 236.7 g/mol
Molecular Formula C12H13ClN2O
Exact Mass 236.071641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EviURDHN4gW
Name N-FORMYL-2-EXO-(2-CHLORO-5-PYRIDYL)-7-AZABICYCLO-[2.2.1]-HEPTANE;ROTAMER-#2
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13ClN2O
InChI InChI=1S/C12H13ClN2O/c13-12-4-1-8(6-14-12)10-5-9-2-3-11(10)15(9)7-16/h1,4,6-7,9-11H,2-3,5H2/t9-,10-,11+/m1/s1
InChIKey ZRCWLLKGTSBWQC-MXWKQRLJSA-N
Literature Reference Author G.M.P.GIBLIN,C.D.JONES,N.S.SIMPKINS
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3689(1998)
Literature Reference DOI 10.1039/a807073c
Molecular Weight 236.701 g/mol
Solvent CDCl3
Source File Reference UWCP9085