Nuclear Magnetic Resonance (NMR) Flashcards
What does NMR stand for?
What happens?
Nuclear Magnetic Resonance
Nucleus and Electrons remain unchanged in NMR
–> no radioactive (ionizing) radiation
–> no chemical reaction
What are different MR imaging and Spectroscopy techniques?
Single Vocel NMR ~16kb (one image)
2D Spectroscopic Imaging ~16MB (32x32 images)
3D SI ~512MB (32x32x32 images)
3D MRSI + multiarray coils ~4GB (8 coilsx512MB)
What properties does the nucleus have?
Spin (angular moment)
Magnetic moment
What are the basic principles of NRM?
Magnetic field gradients to obtain spatial information
Nuclear spin
Magnetic dipole moment
Chemical Shift:
- Different electronic surroundings
- Different magnetic shielding electronic clouds induce a magnetic moment opposed to the static field
- At the nucleus the magnetic field is slightly different from B0
- Resonance frequency
How is a voxel selected?
Selcetion of three Orientations:
- Phase- Direction
- READ - Direction
- SLICE selection
What can in vivo metabolic imaging be used for?
Thousands of studies:
Epilepsy, Multiple Sclerosis, Alzheimer, Dementia, Oncology, Parkinson, AIDS, etc.
What types of Image Contrasts are there?
Proton-Density
T2-Weighting: Transverse Relaxation T2
T1-Weighting: Longitudial Relaxation T1
Diffustion
Flow
BOLD

What is fMRI?
+ Examples
functional-MRI
Blood Oxygenation Level Dependent MRI (BOLD):
To measure brain activation
Motor Stimulation
What is MR Angiography?
Visualize Blood vessels
What is the dixon techique?
Compare Fat & water images
What are the potential risks of MRI?
Metal, pacemaker, heating
But no radiation
What is the basic principle of 1D 1H-NMR?
- All protons in a molecule yield a peak
- Position depends on electronic surroundings of the proton
- Intensity / Area depends on:
- number of contributing protons
- concentration
–> Can be used to distinguish different functional groups in a molecule
What is T2?
Transverse Relaxation
Signal intensity decreases exponentially over time
Show contrast over Echotime TE
Different images between long and short TE

What is T1?
Longitudinal Relaxation
Signal incerases exponentially over time
Show contrast over repetitiontime TR

What is done in a targeted analysis?
Deconvolution:
- Metabolic profiling
- Identification / quantification
Fitting:
Position, Intensity, Linewidth, (Phase)
What is done in a non-targeted analysis?
Statistics:
- Metabolic fingerprinting
- Classification / discrimination
PCA/PLS-DA (like PCA with additional information)
What are possible pitfalls of metabolomics in practice?

What is the general workflow in metabolomics by NMR in practice?
- Sample Collection:
- Dietary control
- Time of sampling
- Storage container
- Storage conditions
- …
- Sample Preparation:
- Urine:
- Buffering
- pH adjustment
- NaN3
- Reference
- Blood:
- Heparin tube
- Saline
- Cenrifuge
- Reference
- Tissue/Cells:
- Intact tissue or extract (Perchloric acid or methanol/chloroform
- Urine:
- NMR measurement:
-
1H-NMR (HR-MAS):
- 1D:
- Dominating
- <10 min
- Automated
- CPMG/Project:
- Separation of small components from:
- Protein
- Lipids
- Separation of small components from:
- 2D J-resolced:
- reducing spectral congestion (separating chemical shift from coupling)
- HSQC:
- Expensive
- Time consuming
- Mostly for identification
- 1D:
- More rare: 13C-NMR:
- HSQC (see above)
-
1H-NMR (HR-MAS):
- Analysis:
- Multivariate Analysis:
- Spectral pre-processing
- Bucketing
- Scaling
- PCA/PLS
- Machine/Deep Learning
- Multivariate Analysis:
- Identification:
- Databases
- Advanced NMR methods (COSY, TOCSY, HSQC)
- Biochemical interpretation:
- Mechanistic insights
What does NMR allow for?
What are possible applications?
NMR allows the measurement, identification and quantification of hundreds of metabolites simultaneously from liquids or biopsies
Applications:
- Metabolomic Applications:
- Toxicity Screening & Disease Diagnosis
- HR-MAS NMR:
- biomedical studies like Cancer Metabolomics
- food science
- Metabolomics NRM-study of Body Fluids
What is clinical NMR?
- Extremely versatile and important in clinical routine as MRI
- Clinical in vivo NMR important in selected cases, but not yet established as routine investigation
- Clinical ex vivo NMR important in selected cases using (targeted) individual peak analysis
- NMR Metabolomics:
- Potential shown in oncology
- Still quite few studies, especially of tissues/biopsies