Predicted GC-MS Spectrum - {4-[(1E)-5-oxo-7-phenylhepta-1,3-dien-1-yl]phenyl}oxidanesulfonic acid GC-MS (Non-derivatized) - 70eV, Positive (HMDB0133927)
Spectrum Details
| HMDB ID: | HMDB0133927 |
|---|---|
| Compound Name: | {4-[(1E)-5-oxo-7-phenylhepta-1,3-dien-1-yl]phenyl}oxidanesulfonic acid |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | Not Available |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - {4-[(1E)-5-oxo-7-phenylhepta-1,3-dien-1-yl]phenyl}oxidanesulfonic acid GC-MS (Non-derivatized) - 70eV, Positive |
| Splash Key: | splash10-002f-3691000000-c4846de991740d6f0c25 |
| 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: | C19H18O5S |
| Molecular Weight (Monoisotopic Mass): | 358.0875 Da |
Notes
Predicted by CFMID-EI, energy0
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 748 Bytes |
| Generated list of m/z values for the spectrum (TXT) | Download file | 748 Bytes |
| mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available