Predicted GC-MS Spectrum - GC-MS (TMS_2_3) - 70eV, Positive (MMDBc0013522)
Spectrum Details
| MiMe ID: | MMDBc0013522 |
|---|---|
| Compound Name: | Altersolanol P |
| Derivative IUPAC Name: | (1S,2R)-1-hydroxy-2-methyl-2,5-bis[(trimethylsilyl)oxy]-1,2,3,4,9,10-hexahydroanthracene-9,10-dione |
| Derivative SMILES: | C[C@@]1(O[Si](C)(C)C)CCC2=C(C(=O)C3=CC=CC(O[Si](C)(C)C)=C3C2=O)[C@@H]1O |
| Derivative InChIKey: | InChIKey=QVXXZYFYDLCEKZ-LEWJYISDSA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_2_3) - 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: | C15H14O5 |
| Molecular Weight (Monoisotopic Mass): | 274.0841 Da |
| Derivative Type: | TMS_2_3 |
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 | 775 Bytes |
| mzML formatted file (MZML) | Download file | 4.63 KB |
References