Predicted GC-MS Spectrum - GC-MS (TMS_1_2) - 70eV, Positive (MMDBc0025498)
Spectrum Details
| MiMe ID: | MMDBc0025498 |
|---|---|
| Compound Name: | Pseudapene A |
| Derivative IUPAC Name: | [(2R,2'S,3R,3'aS,6'aS)-2'-methyl-6'-methylidene-3-(2-methylprop-1-en-1-yl)-3',3'a,6',6'a-tetrahydro-2'H-spiro[oxirane-2,1'-pentalen]-4'-yloxy]trimethylsilane |
| Derivative SMILES: | C=C1C=C(O[Si](C)(C)C)[C@H]2C[C@H](C)[C@@]3(O[C@@H]3C=C(C)C)[C@H]12 |
| Derivative InChIKey: | InChIKey=KONKGUOORISUSM-YKJOPOJSSA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_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: | C15H20O2 |
| Molecular Weight (Monoisotopic Mass): | 232.1463 Da |
| Derivative Type: | TMS_1_2 |
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 | 771 Bytes |
| mzML formatted file (MZML) | Download file | 4.63 KB |
References