4. NMR system overview

Each spectrometer consists of three main components:

Figure 4.1: The main components of an NMR spectrometer

The entire system is controlled nearly 100% from the host computer. The only exceptions are: inserting/removing the sample, tuning the probe (if necessary) depending on the sample (solvent, concentration, salt content etc.).

Input into and control of the system is via keyboard or a three-button mouse:

mouse_color.gif (4575 bytes)

Figure 4.2: Three-button mouse


4.1 Probes and other hardware

The 300 and 600 MHz systems are designated as proton NMR systems with indirect detection of heteronuclei. All others can observe heteronuclei directly. A comparison of available probes and feasible experiments is given in the Table below:

spectrometers and probes
id: indirect detection,
(a)sw (auto)switchable

i300
id

i|m400
asw
ibd5
sw

u500
autoxdb

i600
id

proton 1D Y Y Y Y Y
GCOSY, GTOCSY Y Y Y Y Y
NOESY, ROESY, TROESY Y Y | (Y) Y Y Y
1D versions of 2D with soft pulses N Y | N Y Y Y
gHMQC, gHMBC, gHSQC Y Y Y Y Y
3D techniques N N Y N Y
13C: 1D, APT, DEPT N Y Y Y N
31P 1D, 15N 1D N/N Y/N|Y/N Y/Y Y/Y N/N
HETCOR (13C, 31P) N Y | Y Y Y N
temperature control * Y Y Y Y Y

* spectrometer and probe dependent


4.2 Sensitivity and spectral dispersion

Spectral dispersion is proportional to the field strength hence a 500 is 66% better than a 300 while a 600 is twice as good as a 300. The probability for spectral overlap in a two-dimensional experiment decreases significantly with increasing field strength:

300: 1.0         400: 0.56        500: 0.36        600: 0.25

The sensitivity for protons and resulting experimental times or sample concentration, respectively, to reach the same signal-to-noise ratio is compared below:

spectrometers and probes
id: indirect detection
(a)sw: (auto)switchable

i300
id
--

i400
m400
asw

u500
autoxdb

ibd5
id
sw

i600
id
--

1H sensitivity

170:1
--

250:1
150:1

400:1

900:1
450:1

1200:1
-

experimental time to reach s/n at a given sample concentration [minutes]

75
--

34
96

4
18

2.5
10

1.5
--

sample concentration required to reach s/n in a given time [mM]

50
--

23
64

2.5
11.8

1.8
7.1

1
--

1H sweep width in Hz for 10 ppm

3000

4000

5000

5000

6000


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