Predicted GC-MS Spectrum - GC-MS (TMS_1_1) - 70eV, Positive (MMDBc0054736)
Spectrum Details
| MiMe ID: | MMDBc0054736 |
|---|---|
| Compound Name: | (+)-isoafricanol |
| Derivative IUPAC Name: | {[(1aS,4aR,5R,7aS,7bR)-3,3,5,7b-tetramethyl-decahydro-1H-cyclopropa[e]azulen-4a-yl]oxy}trimethylsilane |
| Derivative SMILES: | C[C@@H]1CC[C@H]2[C@]3(C)C[C@@H]3CC(C)(C)C[C@]21O[Si](C)(C)C |
| Derivative InChIKey: | InChIKey=VMBFIGTVLXUZMX-MISMHTLLSA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_1_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: | C15H26O |
| Molecular Weight (Monoisotopic Mass): | 222.1984 Da |
| Derivative Type: | TMS_1_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 | 767 Bytes |
| mzML formatted file (MZML) | Download file | 4.63 KB |
References