Predicted GC-MS Spectrum - GC-MS (TBDMS_3_49) - 70eV, Positive (CHEM041542)
Spectrum Details
| chemdb ID: | CHEM041542 |
|---|---|
| Compound Name: | 4'-Methylepigallocatechin 3'-glucuronide |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TBDMS_3_49) - 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: | C22H24O13 |
| Molecular Weight (Monoisotopic Mass): | 496.1217 Da |
| Molecular Weight (Avergae Mass): | 496.4182 Da |
| Derivative Type: | TBDMS_3_49 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=C(O)C=C([C@H]2OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C[C@H]2O)C=C1O[C@@H]1O[C@H](C(=O)O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
| mzML formatted file | Download file |
References
Not Available