Predicted GC-MS Spectrum - GC-MS (TMS_2_2) - 70eV, Positive (CHEM031607)
Spectrum Details
| chemdb ID: | CHEM031607 |
|---|---|
| Compound Name: | Bn-NCC-1 |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_2_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: | C37H40N4O11 |
| Molecular Weight (Monoisotopic Mass): | 716.2694 Da |
| Molecular Weight (Avergae Mass): | 716.7337 Da |
| Derivative Type: | TMS_2_2 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C=CC1=C(C)C(CC2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(C3C4=C(C(=O)C3C(=O)O[Si](C)(C)C)C(C)=C(CC3=C(CCOC(=O)CC(=O)O)C(C)=C(C=O)[NH]3)[NH]4)[NH]2)NC1=O)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
| mzML formatted file | Download file |
References
Not Available