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Spectrum Details
HMDB ID:HMDB0000978
Compound Name:4-(2-Aminophenyl)-2,4-dioxobutanoic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:CC(C)(C)[Si](C)(C)OC(=CC(=O)C1=CC=CC=C1N)C(=O)O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 4-(2-Aminophenyl)-2,4-dioxobutanoic acid GC-MS (TBDMS_1_2) - 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:C10H9NO4
Molecular Weight (Monoisotopic Mass):207.0532 Da
Derivative Type:TBDMS_1_2
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(C)(C)[Si](C)(C)OC(=CC(=O)C1=CC=CC=C1N)C(=O)O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file1.53 KB
mzML formatted file (MZML)Download file4.66 KB
References
Not Available