Spectrum Details
MiMe ID:MMDBc0050133
Compound Name:(1R,6S)-6-Amino-5-oxocyclohex-2-ene-1-carboxylate
Derivative IUPAC Name:(1R,6S)-5-oxo-6-[(trimethylsilyl)amino]cyclohex-2-ene-1-carboxylic acid
Derivative SMILES:C[Si](C)(C)N[C@@H]1C(=O)CC=C[C@H]1C(=O)O
Derivative InChIKey:InChIKey=KNAMNOYEDZMIKR-APPZFPTMSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_4) - 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:C7H9NO3
Molecular Weight (Monoisotopic Mass):155.0582 Da
Derivative Type:TMS_1_4
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file773 Bytes
mzML formatted file (MZML)Download file4.63 KB
References