Predicted GC-MS Spectrum - GC-MS (TBDMS_3_58) - 70eV, Positive (CHEM041505)
Spectrum Details
| chemdb ID: | CHEM041505 |
|---|---|
| Compound Name: | Epigallocatechin 3'-glucuronide |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TBDMS_3_58) - 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: | C21H22O13 |
| Molecular Weight (Monoisotopic Mass): | 482.106 Da |
| Molecular Weight (Avergae Mass): | 482.3916 Da |
| Derivative Type: | TBDMS_3_58 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C[C@@H](O)[C@@H](C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C1)O2)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
| mzML formatted file | Download file |
References
Not Available