Predicted GC-MS Spectrum - Cefotetan GC-MS (TBDMS_2_6) - 70eV, Positive (HMDB0015425)
Spectrum Details
| HMDB ID: | HMDB0015425 |
|---|---|
| Compound Name: | Cefotetan |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | CO[C@@]1(N(C(=O)C2SC(=C(C(=O)O)C(=O)N[Si](C)(C)C(C)(C)C)S2)[Si](C)(C)C(C)(C)C)C(=O)N2C(C(=O)O)=C(CSC3=NN=NN3C)CS[C@@H]21 |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - Cefotetan GC-MS (TBDMS_2_6) - 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: | C17H17N7O8S4 |
| Molecular Weight (Monoisotopic Mass): | 575.0021 Da |
| Derivative Type: | TBDMS_2_6 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CO[C@@]1(N(C(=O)C2SC(=C(C(=O)O)C(=O)N[Si](C)(C)C(C)(C)C)S2)[Si](C)(C)C(C)(C)C)C(=O)N2C(C(=O)O)=C(CSC3=NN=NN3C)CS[C@@H]21)
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 757 Bytes |
| mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available