Predicted GC-MS Spectrum - GC-MS (TBDMS_1_2) - 70eV, Positive (CHEM031937)
Spectrum Details
| chemdb ID: | CHEM031937 |
|---|---|
| Compound Name: | Somniferine |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TBDMS_1_2) - 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: | C36H36N2O7 |
| Molecular Weight (Monoisotopic Mass): | 608.2523 Da |
| Molecular Weight (Avergae Mass): | 608.6802 Da |
| Derivative Type: | TBDMS_1_2 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=CC=C2[C@H]3CC4=CC=C(OC)C5=C4[C@@]2(C[C@@H](C2=C[C@@]4(O)[C@H]6CC7=CC=C(O[Si](C)(C)C(C)(C)C)C8=C7[C@@]4(CCN6C)[C@@H](O8)C2=O)N3C)[C@H]1O5)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
| mzML formatted file | Download file |
References
Not Available