Predicted GC-MS Spectrum - GC-MS (TMS_1_5) - 70eV, Positive (CHEM032112)
Spectrum Details
| chemdb ID: | CHEM032112 |
|---|---|
| Compound Name: | (3''-Apiosyl-6''-malonyl)astragalin |
| 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: | C29H30O18 |
| Molecular Weight (Monoisotopic Mass): | 666.1432 Da |
| Molecular Weight (Avergae Mass): | 666.5377 Da |
| Derivative Type: | TMS_1_5 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)OC1=CC(O)=C2C(=O)C(OC3OC(COC(=O)CC(=O)O)C(O)C(OC4OCC(O)(CO)C4O)C3O)=C(C3=CC=C(O)C=C3)OC2=C1)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
| mzML formatted file | Download file |
References
Not Available