Predicted GC-MS Spectrum - GC-MS (TMS_1_5) - 70eV, Positive (MMDBc0030320)
Spectrum Details
| MiMe ID: | MMDBc0030320 |
|---|---|
| Compound Name: | Maltopentaose |
| Derivative IUPAC Name: | 2-({6-[(6-{[4,5-dihydroxy-2-(hydroxymethyl)-6-[2,3,4-trihydroxy-1-(hydroxymethoxy)butoxy]oxan-3-yl]oxy}-2,4,5-trihydroxyoxan-3-yl)oxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl}oxy)-6-[(trimethylsilyl)oxy]oxane-3,4,5-triol |
| Derivative SMILES: | C[Si](C)(C)OC1OC(OC2C(CO)OC(OC3C(O)OC(OC4C(CO)OC(OC(OCO)C(O)C(O)CO)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| Derivative InChIKey: | InChIKey=XEYGBYKGZJBYGJ-UHFFFAOYNA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_1_5) - 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: | C27H48O26 |
| Molecular Weight (Monoisotopic Mass): | 788.2434 Da |
| Derivative Type: | TMS_1_5 |
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 | 778 Bytes |
| mzML formatted file (MZML) | Download file | 4.63 KB |
References