Table 1.
NMR | GC-MS | LC-MS | |
---|---|---|---|
Applications | Targeted and untargeted | Targeted and untargeted | Targeted and untargeted |
Throughput | 10–30 min | 20–60 min | 15–60 min |
Advantages | Nondestructive and suitable for in vivo | Sensitive | Highly sensitive |
Quantitative of absolute concentrations | Quantitative of absolute concentrations | Wide dynamic range | |
Requiring little or no sample preparation | Robust and reproducible | No need for derivatization | |
Automated and robust | Small sample volume required (~1 uL) | Small sample volume required (10–100 uL) | |
Highly reproducible | Available databases for identification (i.e., NIST) | Compatible with solids and liquids | |
Less expensive compared with LC-MS | |||
Disadvantages | Poor sensitivity | Destructive | Destructive |
Large sample volumes required (~0.5 mL) | Requiring derivatization and separation | Requiring separation | |
Not compatible with solids | Lack of absolute quantification in untargeted applications | ||
Less reproducible | |||
Difficulty in unknown metabolite identification | |||
More expensive compared with GC-MS |
GC-MS, gas chromatography–mass spectrometry; LC-MS, liquid chromatography–mass spectrometry; NIST, National Institute of Standards and Technology; NMR, nuclear magnetic resonance.