Predicted GC-MS Spectrum - GC-MS (TMS_4_82) - 70eV, Positive (MMDBc0030189)
Spectrum Details
| MiMe ID: | MMDBc0030189 |
|---|---|
| Compound Name: | Fructoselysine-6-phosphate |
| Derivative IUPAC Name: | {[3,4-dihydroxy-6-(2,2,10,10-tetramethyl-8-{[(trimethylsilyl)oxy]carbonyl}-3,9-diaza-2,10-disilaundecan-3-yl)-5-[(trimethylsilyl)oxy]-3,6-dihydro-2H-pyran-2-yl]methoxy}phosphonic acid |
| Derivative SMILES: | C[Si](C)(C)NC(CCCCN(C1OC(COP(=O)(O)O)C(O)C(O)=C1O[Si](C)(C)C)[Si](C)(C)C)C(=O)O[Si](C)(C)C |
| Derivative InChIKey: | InChIKey=AQADVWWGFMLROX-UHFFFAOYNA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_4_82) - 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: | C12H23N2O10P |
| Molecular Weight (Monoisotopic Mass): | 386.109 Da |
| Derivative Type: | TMS_4_82 |
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 | 772 Bytes |
| mzML formatted file (MZML) | Download file | 4.64 KB |
References