Predicted GC-MS Spectrum - GC-MS (TMS_2_6) - 70eV, Positive (MMDBc0031893)
Spectrum Details
| MiMe ID: | MMDBc0031893 |
|---|---|
| Compound Name: | Deoxyuridine-5'-diphosphate |
| Derivative IUPAC Name: | ({bis[(trimethylsilyl)oxy]phosphoryl}oxy)({[(2S,3R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy})phosphinic acid |
| Derivative SMILES: | C[Si](C)(C)OP(=O)(O[Si](C)(C)C)O[P@](=O)(O)OC[C@@H]1O[C@@H](N2C=CC(=O)NC2=O)C[C@H]1O |
| Derivative InChIKey: | InChIKey=MPXPHMPSYQRBBN-MBNYWOFBSA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_2_6) - 70eV, Positive |
| Splash Key: | Not Available |
| Notes: | This is a predicted spectrum, and it should only be used as a guide. Further evidence is required to confirm identification. |
Spectrum View
Experimental Conditions
| Ionization Mode: | Positive |
|---|---|
| Ionization Energy: | 70 eV |
| Chromatography Type: | Gas Chromatography Column (GC) |
| Instrument Type: | Single quadrupole, spectrum predicted by CFM-ID(EI) |
| Mass Resolution: | 0.0001 Da |
| Molecular Formula: | C9H14N2O11P2 |
| Molecular Weight (Monoisotopic Mass): | 388.0073 Da |
| Derivative Type: | TMS_2_6 |
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Generated list of m/z values for the spectrum (TSV) | Download file | 768 Bytes |
| mzML formatted file (MZML) | Download file | 4.63 KB |
References