Predicted GC-MS Spectrum - GC-MS (TMS_2_16) - 70eV, Positive (CHEM032529)
Spectrum Details
| chemdb ID: | CHEM032529 |
|---|---|
| Compound Name: | 6-Cinnamoyl-1,2-digalloylglucose |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_2_16) - 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: | C29H26O15 |
| Molecular Weight (Monoisotopic Mass): | 614.1272 Da |
| Molecular Weight (Avergae Mass): | 614.5077 Da |
| Derivative Type: | TMS_2_16 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(COC(=O)/C=C/C3=CC=CC=C3)C(O)C2O)=CC(O)=C1O[Si](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