Predicted GC-MS Spectrum - GC-MS (TMS_1_1) - 70eV, Positive (MMDBc0013534)
Spectrum Details
| MiMe ID: | MMDBc0013534 |
|---|---|
| Compound Name: | Asperversin A |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | COC1=C2OC3=C(C(OC)=CC4=C3[C@@H]3C[C@H](O[C@H]5CC[C@]6(C)[C@H]7CC[C@]8(C)[C@@H]([C@H](C)C=C[C@H](C)C(C)C)CC[C@H]8[C@@]78C=C[C@]6(C5)OO8)O[C@@H]3O4)C(=O)C2=C(O[Si](C)(C)C)C=C1 |
| Derivative InChIKey: | Not Available |
| 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: | C47H58O10 |
| Molecular Weight (Monoisotopic Mass): | 782.403 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 | 777 Bytes |
| mzML formatted file (MZML) | Download file | 4.64 KB |
References