1H NMR Spectrum (1D, 700 MHz, D2O, predicted) (HMDB0060505)
Spectrum Details
| HMDB ID: | HMDB0060505 |
|---|---|
| Compound name: | S-(2-Chloroacetyl)glutathione |
| Spectrum type: | 1H NMR Spectrum (1D, 700 MHz, D2O, predicted) |
Spectrum View
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| Assignment Table | |||||||
|---|---|---|---|---|---|---|---|
| Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. H's | Atom No. | Peak Centers (ppm) | |
| 1 | 3.85 | 1 | s | 2 | 36 37 | 3.85 | |
| 2 | 3.84 | 3 | t | 1 | 33 | 3.853.843.83 | |
| 3 | 3.77 | 3 | t | 1 | 27 | 3.783.773.76 | |
| 4 | 3.74 | 1 | s | 2 | 39 40 | 3.74 | |
| 5 | 3.38 | 4 | dd | 1 | 35 | 3.393.383.383.37 | |
| 6 | 3.18 | 4 | dd | 1 | 34 | 3.193.183.183.17 | |
| 7 | 2.58 | 6 | dt | 1 | 31 | 2.602.592.582.582.572.56 | |
| 8 | 2.42 | 6 | dt | 1 | 30 | 2.442.432.422.422.412.40 | |
| 9 | 2.14 | 12 | dtd | 1 | 29 | 2.162.162.152.152.152.142.142.132.132.132.122.12 | |
| 10 | 2.11 | 12 | dtd | 1 | 28 | 2.132.132.122.122.122.112.112.102.102.102.092.09 | |
Experimental Conditions
| Solvent: | D2O |
|---|---|
| Nucleus: | 1H |
| Frequency: | 700 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 2.37 KB |
| Peak Assignments (TXT) | Download file | 612 Bytes |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 284 KB |
| JCAMP-DX File (JDX) | Download file | 81 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available