Predicted GC-MS Spectrum - 26-Glucosyl-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oate GC-MS (TMS_2_1) - 70eV, Positive (HMDB0040405)
Spectrum Details
| HMDB ID: | HMDB0040405 |
|---|---|
| Compound Name: | 26-Glucosyl-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oate |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | C/C(CC(O[Si](C)(C)C)C(C)C1CCC2C3CC=C4CC(O[Si](C)(C)C)CC(O)C4(C)C3C(O)CC12C)=C(\C)C(=O)OC1OC(CO)C(O)C(O)C1O |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - 26-Glucosyl-1,3,11,22-tetrahydroxyergosta-5,24-dien-26-oate GC-MS (TMS_2_1) - 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: | C34H54O11 |
| Molecular Weight (Monoisotopic Mass): | 638.3666 Da |
| Derivative Type: | TMS_2_1 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C/C(CC(O[Si](C)(C)C)C(C)C1CCC2C3CC=C4CC(O[Si](C)(C)C)CC(O)C4(C)C3C(O)CC12C)=C(\C)C(=O)OC1OC(CO)C(O)C(O)C1O)
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 754 Bytes |
| mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available