Predicted GC-MS Spectrum - (2S)-2-(Benzenesulfonamido)-N-[(1S)-1-hydroxy-3-methyl-1-(3-oxo-2-phenylcyclopropen-1-yl)butan-2-yl]-4-methylpentanamide GC-MS (TMS_1_1) - 70eV, Positive (HMDB0257652)
Spectrum Details
| HMDB ID: | HMDB0257652 |
|---|---|
| Compound Name: | (2S)-2-(Benzenesulfonamido)-N-[(1S)-1-hydroxy-3-methyl-1-(3-oxo-2-phenylcyclopropen-1-yl)butan-2-yl]-4-methylpentanamide |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | CC(C)CC(NS(=O)(=O)C1=CC=CC=C1)C(=O)NC(C(C)C)C(O[Si](C)(C)C)C1=C(C2=CC=CC=C2)C1=O |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - (2S)-2-(Benzenesulfonamido)-N-[(1S)-1-hydroxy-3-methyl-1-(3-oxo-2-phenylcyclopropen-1-yl)butan-2-yl]-4-methylpentanamide 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: | C26H32N2O5S |
| Molecular Weight (Monoisotopic Mass): | 484.2032 Da |
| Derivative Type: | TMS_1_1 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(C)CC(NS(=O)(=O)C1=CC=CC=C1)C(=O)NC(C(C)C)C(O[Si](C)(C)C)C1=C(C2=CC=CC=C2)C1=O)
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 746 Bytes |
| mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available