Predicted GC-MS Spectrum - (+/-)-3-(Methylthio)heptanal GC-MS (Non-derivatized) - 70eV, Positive (HMDB0032426)
Spectrum Details
| HMDB ID: | HMDB0032426 |
|---|---|
| Compound Name: | (+/-)-3-(Methylthio)heptanal |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | Not Available |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - (+/-)-3-(Methylthio)heptanal GC-MS (Non-derivatized) - 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: | C8H16OS |
| Molecular Weight (Monoisotopic Mass): | 160.0922 Da |
Notes
Predicted by CFMID-EI, energy0
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 744 Bytes |
| mzML formatted file (MZML) | Download file | 4.58 KB |
References
Not Available