1H NMR Spectrum (1D, 100 MHz, H2O, predicted) (NP0177305)
Spectrum Details
| NP-MRD ID: | NP0177305 |
|---|---|
| Compound name: | (9r,10e,12s,13s)-9,12,13-trihydroxyoctadec-10-enoic acid |
| Spectrum type: | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) |
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| Peak Assignment Table | |||||||
|---|---|---|---|---|---|---|---|
| Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. H's | Atom No. | Peak Centers (ppm) | |
| 1 | 6.15 | 4 | dd | 1 | 39 | 6.046.116.196.26 | |
| 2 | 5.54 | 4 | dd | 1 | 40 | 5.435.505.585.65 | |
| 3 | 4.62 | 13 | dt | 1 | 41 | 4.394.464.514.564.584.624.624.634.644.694.694.804.87 | |
| 4 | 4.22 | 4 | dd | 1 | 37 | 4.164.214.234.28 | |
| 5 | 3.87 | 24 | td | 1 | 35 | 3.693.723.743.753.773.813.833.843.853.863.863.883.883.893.903.903.913.923.933.953.974.024.044.09 | |
| 6 | 2.32 | 14 | t | 2 | 55 56 | 2.242.242.362.372.372.552.122.232.242.302.312.362.372.37 | |
| 7 | 1.51 | 59 | td | 2 | 43 44 | 1.261.351.361.371.391.401.421.421.431.441.451.471.501.511.511.531.541.571.581.591.601.631.231.281.301.311.341.361.371.381.401.421.441.441.471.501.511.511.521.531.541.561.571.581.591.601.601.621.631.641.651.671.681.701.701.711.751.771.78 | |
| 8 | 1.45 | 51 | tt | 2 | 53 54 | 1.211.291.321.321.341.341.361.371.371.391.401.401.431.441.451.461.491.491.501.511.521.561.631.631.201.231.261.301.351.361.381.401.431.441.451.471.491.491.501.511.521.551.561.571.581.611.621.631.631.691.70 | |
| 9 | 1.39 | 40 | td | 2 | 33 34 | 1.291.311.341.351.371.381.401.411.431.451.471.491.511.521.541.561.571.591.191.201.211.231.241.261.271.291.311.331.341.351.371.381.401.421.451.471.511.511.521.53 | |
| 10 | 1.38 | 66 | m | 2 | 45 46 | 1.171.201.211.221.241.261.271.271.281.291.291.301.311.321.331.341.361.381.401.401.421.441.471.491.511.521.561.621.651.781.161.171.221.221.241.261.271.291.291.301.311.321.321.331.341.351.361.381.401.401.411.441.451.461.471.481.491.501.511.511.521.531.541.551.561.61 | |
| 11 | 1.35 | 57 | m | 2 | 31 32 | 1.161.181.191.211.231.241.261.261.281.281.301.301.311.331.331.341.351.361.381.381.391.421.451.461.491.171.181.191.211.241.261.261.281.291.311.331.331.341.351.361.361.371.381.391.391.411.421.431.451.471.481.491.521.531.561.571.58 | |
| 12 | 1.33 | 74 | tt | 2 | 29 30 | 1.031.081.101.141.141.151.161.181.181.191.221.241.251.261.271.291.301.321.331.331.341.361.371.391.401.421.431.441.451.461.461.471.481.491.511.531.531.551.561.141.151.151.161.191.201.231.241.251.261.271.281.291.301.311.321.331.331.341.351.361.371.381.391.401.411.421.431.441.441.461.521.531.541.55 | |
| 13 | 1.33 | 69 | m | 2 | 27 28 | 1.011.151.181.191.201.211.221.231.241.251.271.271.281.291.301.301.321.341.351.381.381.391.401.411.421.441.461.471.481.491.111.151.161.171.181.191.211.221.231.241.251.271.271.281.291.301.321.331.351.351.361.371.371.381.391.401.421.441.451.461.471.481.491.491.511.531.531.541.59 | |
| 14 | 1.31 | 62 | m | 2 | 47 48 | 1.091.121.131.151.161.181.201.211.221.251.261.271.291.291.301.311.331.341.351.361.371.391.401.411.431.441.451.471.491.501.511.101.121.131.171.181.201.201.211.231.251.251.261.271.281.291.301.311.331.341.351.351.361.391.401.411.431.441.471.491.501.51 | |
| 15 | 1.28 | 118 | m | 4 | 49 50 51 52 | 1.081.101.121.141.151.161.171.191.201.211.221.241.251.291.301.311.321.331.341.341.361.391.391.421.431.451.531.101.111.131.151.161.171.201.201.211.221.241.251.251.271.301.311.311.321.331.331.341.371.381.401.421.441.451.471.541.101.141.151.161.171.191.211.221.221.241.241.251.251.271.291.311.321.331.341.341.361.371.381.391.411.421.431.451.461.091.101.101.131.151.161.171.181.191.211.211.221.241.241.251.251.281.291.301.311.321.331.341.351.361.381.391.401.411.411.431.451.46 | |
| 16 | 0.90 | 64 | t | 3 | 24 25 26 | 0.750.770.790.810.820.830.850.870.880.900.910.930.940.941.001.011.041.051.061.100.700.730.740.770.790.810.820.830.850.870.880.910.930.940.951.001.031.041.041.051.100.690.730.750.780.790.800.810.820.840.850.870.880.900.900.910.930.940.951.011.031.041.051.10 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 1H |
| Frequency: | 100 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 42.3 KB |
| Peak Assignments (TXT) | Download file | 954 Bytes |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 616 KB |
| JCAMP-DX File (JDX) | Download file | 209 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available