1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) (HMDB0001957)
Spectrum Details
HMDB ID: | HMDB0001957 |
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Compound name: | Pentacarboxyl porphyrinogen III |
Spectrum type: | 1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) |
Spectrum View
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Assignment Table | |||||||
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Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. H's | Atom No. | Peak Centers (ppm) | |
1 | 7.29 | 1 | s | 1 | 83 | 7.29 | |
2 | 7.22 | 1 | s | 1 | 73 | 7.22 | |
3 | 3.78 | 1 | s | 1 | 60 | 3.78 | |
4 | 3.49 | 1 | s | 2 | 75 76 | 3.49 | |
5 | 3.49 | 4 | dd | 1 | 72 | 3.503.493.493.48 | |
6 | 2.84 | 6 | dt | 1 | 56 | 2.852.852.842.842.832.83 | |
7 | 2.58 | 6 | dt | 1 | 66 | 2.592.592.582.582.572.57 | |
8 | 2.58 | 1 | s | 3 | 62 63 64 | 2.58 | |
9 | 2.58 | 1 | s | 3 | 52 53 54 | 2.58 | |
10 | 2.58 | 6 | dt | 1 | 55 | 2.592.592.582.582.572.57 | |
11 | 2.48 | 6 | dt | 1 | 67 | 2.492.492.482.482.472.47 | |
12 | 2.48 | 3 | t | 2 | 57 58 | 2.492.482.47 | |
13 | 2.25 | 3 | t | 2 | 86 87 | 2.262.252.24 | |
14 | 2.25 | 3 | t | 2 | 80 81 | 2.262.252.24 | |
15 | 2.25 | 4 | dd | 1 | 70 | 2.262.252.252.24 | |
16 | 2.25 | 6 | dt | 1 | 68 | 2.262.262.252.252.242.24 | |
17 | 2.17 | 3 | t | 2 | 84 85 | 2.182.172.16 | |
18 | 2.17 | 3 | t | 2 | 78 79 | 2.182.172.16 | |
19 | 2.09 | 4 | dd | 1 | 71 | 2.102.102.082.08 | |
20 | 1.76 | 6 | dt | 1 | 65 | 1.771.771.761.761.751.75 | |
21 | 1.62 | 1 | s | 3 | 89 90 91 | 1.62 |
Experimental Conditions
Solvent: | D2O |
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Nucleus: | 1H |
Frequency: | 1000 MHz |
Documentation
Document Description | Download | File Size |
---|---|---|
Peak List (TXT) | Download file | 5.71 KB |
Peak Assignments (TXT) | Download file | 1.32 KB |
Spectra Image with Peak Assignments | Not Available | Not Available |
Raw Spectrum Image | Not Available | Not Available |
nmrML File (NMRML) | Download file | 292 KB |
JCAMP-DX File (JDX) | Download file | 87.3 KB |
Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
Validation Report | Not Available | Not Available |
References
Not Available