Predicted GC-MS Spectrum - GC-MS (TMS_1_4) - 70eV, Positive (CHEM033953)
Spectrum Details
| chemdb ID: | CHEM033953 |
|---|---|
| Compound Name: | Natsudaidain 3-(4-O-3-hydroxy-3-methylglutaroylglucoside) |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_1_4) - 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: | C33H40O18 |
| Molecular Weight (Monoisotopic Mass): | 724.2215 Da |
| Molecular Weight (Avergae Mass): | 724.6599 Da |
| Derivative Type: | TMS_1_4 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=CC=C(C2=C(OC3OC(CO)C(OC(=O)CC(C)(O)CC(=O)O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(OC)C(OC)=C(OC)C(OC)=C3O2)C=C1OC)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
| mzML formatted file | Download file |
References
Not Available