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PICOLINIC_ACID_N-OXIDE-MONODEUTERATED
SpectraBase Compound ID ACqDmVUkWA3
InChI InChI=1S/C6H5NO3/c8-6(9)5-3-1-2-4-7(5)10/h1-4H,(H,8,9)/i/hD
InChIKey FHYMLBVGNFVFBT-DYCDLGHISA-N
Mol Weight 140.12 g/mol
Molecular Formula C6H42HNO3
Exact Mass 140.03322 g/mol
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3CN
Title Journal or Book Year
Density Functional Calculation of the 2D Potential Surface and Deuterium Isotope Effect on 13C Chemical Shifts in Picolinic Acid N-Oxide. Comparison with Experiment Journal of the American Chemical Society 2004

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