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    NMR Analytical Chemistry

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    Tamara Chachi-Baía do Santiago
    Nuclear magnetic resonance (NMR) spectroscopy is a technique used in bio-medical research. It involves exposing atomic nuclei with spin to strong magnetic fields and measuring the electromagnetic radiation emitted. NMR provides information about molecular structure by detecting atomic nuclei and the small magnetic fields around them. The document discusses the fundamental principles of NMR, instrumentation used, solvents, chemical shifts, and applications of NMR spectra including interpretation of proton chemical shifts.

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    NMR Analytical Chemistry

    Uploaded by

    Tamara Chachi-Baía do Santiago
    19 views40 pages
    Nuclear magnetic resonance (NMR) spectroscopy is a technique used in bio-medical research. It involves exposing atomic nuclei with spin to strong magnetic fields and measuring the electromagnetic radiation emitted. NMR provides information about molecular structure by detecting atomic nuclei and the small magnetic fields around them. The document discusses the fundamental principles of NMR, instrumentation used, solvents, chemical shifts, and applications of NMR spectra including interpretation of proton chemical shifts.

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    NMR Analytical Chemistry

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    Nuclear magnetic resonance (NMR) spectroscopy is a technique used in bio-medical research. It involves exposing atomic nuclei with spin to strong magnetic fields and measuring the electromagnetic radiation emitted. NMR provides information about molecular structure by detecting atomic nuclei and the small magnetic fields around them. The document discusses the fundamental principles of NMR, instrumentation used, solvents, chemical shifts, and applications of NMR spectra including interpretation of proton chemical shifts.

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    © All Rights Reserved
    Download as PDF, TXT or read online from Scribd
    Download as pdf or txt
    19 views40 pages

    NMR Analytical Chemistry

    Uploaded by

    Tamara Chachi-Baía do Santiago
    Nuclear magnetic resonance (NMR) spectroscopy is a technique used in bio-medical research. It involves exposing atomic nuclei with spin to strong magnetic fields and measuring the electromagnetic radiation emitted. NMR provides information about molecular structure by detecting atomic nuclei and the small magnetic fields around them. The document discusses the fundamental principles of NMR, instrumentation used, solvents, chemical shifts, and applications of NMR spectra including interpretation of proton chemical shifts.

    Copyright:

    © All Rights Reserved
    Download as PDF, TXT or read online from Scribd
    Download as pdf or txt
    of 40

    Method of Nuclear Magnetic

    Resonance Spectroscopy for


    application in bio-medical
    research
    Dr. Tamar Chachibaia, MD, PhD,
    Associate Professor
    25 March 2016
    BAU International University, Batumi
    • Introduction
    • Fundamental principles and theory
    • Instrumentation
    • Solvents in NMR spectroscopy
    • Chemical shift
    • Interpretation of Proton chemical shifts
    • Applications NMR spectra
    Introduction

    • Nuclear magnetic resonance, or NMR is a phenomenon


    which occurs when the nuclei of certain atoms are
    immersed in a static magnetic field and exposed to a
    second oscillating magnetic field. Some nuclei
    experience this phenomenon, and others do not,
    dependent upon whether they possess a property called
    spin.
    • The first nuclear magnetic resonance (NMR) was
    detected early in 1938 in a molecular beam, and the first
    studies of NMR in bulk materials were carried out about
    8 years later.
    • In 1952 F. Bloch and E. Purcel were awarded by the
    Nobel Prize.
    The Nobel Prize in Physics 1952 was awarded jointly to Felix
    Bloch and Edward Mills Purcell "for their development of new
    methods for nuclear magnetic precision measurements and
    discoveries in connection therewith"
    Nuclear Magnetic Resonance (NMR) is a spectroscopy
    technique
    NMR spectroscops

    • Bruker DRX-
    500 (CACTUS)
    • 1H/13C/15N
    http://www.usc.es/g
    • Varian Inova l/investigacion/riaid
    750 (CACTUS)
    • HCN (1H /13C t/rm/rmn/modules/e
    /15N) – quipamento/equipa
    • http://www.usc.es/g mento_0007.html
    l/investigacion/riaid
    t/rm/rmn/modules/e
    quipamento/equipa
    mento_0008.html
    How to prepare sample for analysis
    Open - GOM-Player
    • Refilling_Nitrogen_in_BRUKER_Magnets_
    V10_720p
    • Nucleus with spin I=0 in magnetic field
    (Bo) is rotating in the direction of axis. In
    case of spin I=1/2, are aligned clockwise
    or counterclockwise to the Bo.
    Spin
    Nuclei with Spin

    • The shell model for the nucleus tells us that nucleons,


    just like electrons, fill orbitals. When the number of
    protons or neutrons equals 2, 8, 20, 28, 50, 82, and 126,
    orbitals are filled. Because nucleons have spin, just like
    electrons do, their spin can pair up when the orbitals are
    being filled and cancel out. Almost every element in the
    periodic table has an isotope with a non zero nuclear
    spin.
    • NMR can only be performed on isotopes whose natural
    abundance is high enough to be detected.
    • Some of the nuclei routinely used in NMR are listed
    below.
    Nuclei with Spin
    γ
    Nucle Unpaired Unpaired Net
    (MHz/
    i Protons Neutrons Spin
    T)
    1 H 1 0 1/2 42.58
    2 H 1 1 1 6.54
    31 P 1 0 1/2 17.25
    23 Na 1 2 3/2 11.27
    14 N 1 1 1 3.08
    13 C 0 1 1/2 10.71
    19 F 1 0 1/2 40.08
    Spin and other characteristics of main nuclei
    How to convert signal to spectra
    • As a result of impulse spectroscopy it is possible to obtain not only
    the usual spectrum with visible peaks of resonance, but the image of
    damped resonant oscillations, in which the signals are mixed from
    all the resonant nuclei. It is called the free induction decay (FID). In
    order to convert this spectrum, it is necessary to use mathematical
    methods, the so-called ourier transformation, by which any function
    can be represented as the sum of the set of harmonic oscillations.
    • In other words, "the required acquisition time depends on the
    smallest line width in the spectrum, and truncation of the NMR signal
    in the time domain [free induction decay (FID)] must be avoided.
    • If truncation occurs, signal forms with (substantial) "wiggles" appear
    in the spectra, and, in combination with FID baseline correction
    modes, wrong intensities will result" (Diehl et al., 16).
    FID
    (http://www.sci.utu.fi/kemia/tutkimu
    s/laitekeskus).
    Recommended readings :
    Thank you! Questions?

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