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Spectrum Details
HMDB ID:HMDB0245844
Compound Name:3-Cyanoalanine
Derivative IUPAC Name:Not Available
Derivative SMILES:Not Available
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 3-Cyanoalanine GC-MS (Non-derivatized) - 70eV, Positive
Splash Key:splash10-014i-9000000000-b588e4f0716ef2c3b6ea
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:C4H6N2O2
Molecular Weight (Monoisotopic Mass):114.0429 Da
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file431 Bytes
mzML formatted file (MZML)Download file4.38 KB
References
Not Available