Predicted GC-MS Spectrum - GC-MS (TMS_2_3) - 70eV, Positive (MMDBc0017912)
Spectrum Details
| MiMe ID: | MMDBc0017912 |
|---|---|
| Compound Name: | (-)-(7R,10R)-iso-10-hydroxysydowic acid |
| Derivative IUPAC Name: | trimethylsilyl 3-hydroxy-4-[(2R,5R)-2-methyl-5-{2-[(trimethylsilyl)oxy]propan-2-yl}oxolan-2-yl]benzoate |
| Derivative SMILES: | CC(C)(O[Si](C)(C)C)[C@H]1CC[C@](C)(C2=CC=C(C(=O)O[Si](C)(C)C)C=C2O)O1 |
| Derivative InChIKey: | InChIKey=RDWZSLJWAWIWJJ-WIYYLYMNSA-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: | C15H20O5 |
| Molecular Weight (Monoisotopic Mass): | 280.1311 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 | 774 Bytes |
| mzML formatted file (MZML) | Download file | 4.63 KB |
References