Spectrum Details
MiMe ID:MMDBc0000370
Compound Name:Ureidosuccinic acid
Derivative IUPAC Name:(2S)-2-[carbamoyl(trimethylsilyl)amino]-4-oxo-4-[(trimethylsilyl)oxy]butanoic acid
Derivative SMILES:C[Si](C)(C)OC(=O)C[C@@H](C(=O)O)N(C(N)=O)[Si](C)(C)C
Derivative InChIKey:InChIKey=XOXATLFNWMDWEQ-QMMMGPOBSA-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:C5H8N2O5
Molecular Weight (Monoisotopic Mass):176.0433 Da
Derivative Type:TMS_2_3
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)OC(=O)C[C@@H](C(=O)O)N(C(N)=O)[Si](C)(C)C)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file747 Bytes
mzML formatted file (MZML)Download file4.67 KB
References
Not Available