Predicted GC-MS Spectrum - GC-MS (TMS_2_1) - 70eV, Positive (MMDBc0024392)
Spectrum Details
| MiMe ID: | MMDBc0024392 |
|---|---|
| Compound Name: | (+)-floridamide |
| Derivative IUPAC Name: | 3-benzyl-2,6,13,13-tetramethyl-12-pentyl-9-(propan-2-yl)-4,7-bis[(trimethylsilyl)oxy]-1H,2H,3H,6H,9H,10H,12H,13H,14H,16H,17H,18H,18aH-pyrrolo[2,1-l]1-oxa-4,7,10,13-tetraazacyclohexadecane-1,10,14-trione |
| Derivative SMILES: | CCCCCC1OC(=O)C(C(C)C)N=C(O[Si](C)(C)C)C(C)N=C(O[Si](C)(C)C)C(CC2=CC=CC=C2)N(C)C(=O)C2CCCN2C(=O)C1(C)C |
| Derivative InChIKey: | InChIKey=QZHOUSZENOLMGA-UHFFFAOYNA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_2_1) - 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: | C33H50N4O6 |
| Molecular Weight (Monoisotopic Mass): | 598.373 Da |
| Derivative Type: | TMS_2_1 |
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Generated list of m/z values for the spectrum (TSV) | Download file | 770 Bytes |
| mzML formatted file (MZML) | Download file | 4.63 KB |
References