1H NMR Spectrum (1D, 200 MHz, H2O, predicted) (HMDB0001278)
Spectrum Details
HMDB ID: | HMDB0001278 |
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Compound name: | Presqualene diphosphate |
Spectrum type: | 1H NMR Spectrum (1D, 200 MHz, H2O, 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 | 5.92 | 2 | d | 1 | 62 | 5.905.94 | |
2 | 5.13 | 3 | t | 1 | 77 | 5.105.135.17 | |
3 | 5.08 | 16 | t | 1 | 54 | 4.985.005.025.035.055.065.075.075.085.095.105.125.145.145.145.18 | |
4 | 5.08 | 13 | t | 1 | 85 | 4.944.954.995.025.065.065.095.095.125.125.135.205.23 | |
5 | 5.08 | 13 | t | 1 | 46 | 4.944.954.995.025.065.065.095.095.125.125.135.205.23 | |
6 | 4.07 | 4 | dd | 2 | 65 66 | 4.044.074.074.10 | |
7 | 2.83 | 12 | dtd | 1 | 64 | 2.772.792.802.812.822.832.832.842.852.862.872.89 | |
8 | 2.17 | 14 | t | 2 | 57 58 | 2.082.102.152.152.162.202.232.152.152.162.172.202.222.23 | |
9 | 2.14 | 14 | q | 2 | 55 56 | 2.072.092.142.142.162.212.062.092.122.142.142.162.162.23 | |
10 | 2.12 | 9 | dt | 2 | 75 76 | 2.162.062.062.092.102.132.132.162.16 | |
11 | 2.10 | 3 | dd | 1 | 63 | 2.062.102.13 | |
12 | 2.06 | 16 | q | 2 | 83 84 | 2.042.082.081.932.002.012.032.042.042.062.072.072.082.102.112.17 | |
13 | 2.06 | 16 | q | 2 | 47 48 | 2.042.082.081.932.002.012.032.042.042.062.072.072.082.102.112.17 | |
14 | 1.94 | 18 | t | 2 | 81 82 | 1.901.921.971.981.982.061.841.871.901.911.921.931.951.951.971.981.981.98 | |
15 | 1.94 | 18 | t | 2 | 49 50 | 1.901.921.971.981.982.061.841.871.901.911.921.931.951.951.971.981.981.98 | |
16 | 1.72 | 7 | t | 2 | 73 74 | 1.721.681.691.721.721.751.75 | |
17 | 1.71 | 1 | s | 3 | 59 60 61 | 1.71 | |
18 | 1.66 | 1 | s | 3 | 78 79 80 | 1.66 | |
19 | 1.66 | 1 | s | 3 | 51 52 53 | 1.66 | |
20 | 1.63 | 1 | s | 6 | 86 87 88 89 90 91 | 1.63 | |
21 | 1.63 | 1 | s | 6 | 40 41 42 43 44 45 | 1.63 | |
22 | 1.40 | 1 | s | 3 | 70 71 72 | 1.40 |
Experimental Conditions
Solvent: | H2O |
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Nucleus: | 1H |
Frequency: | 200 MHz |
Documentation
Document Description | Download | File Size |
---|---|---|
Peak List (TXT) | Download file | 12.9 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 | 576 KB |
JCAMP-DX File (JDX) | Download file | 170 KB |
Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
Validation Report | Not Available | Not Available |
References
Not Available