Hmdb loader
Spectrum Details
HMDB ID:HMDB0255797
Compound Name:2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-3-(1H-indol-3-yl)-propionic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:C[Si](C)(C)N1C=C(CC(C(=O)O)N2C(=O)C3=CC=CC=C3C2=O)C2=CC=CC=C21
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-3-(1H-indol-3-yl)-propionic acid GC-MS (TMS_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:C19H14N2O4
Molecular Weight (Monoisotopic Mass):334.0954 Da
Derivative Type:TMS_1_2
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)N1C=C(CC(C(=O)O)N2C(=O)C3=CC=CC=C3C2=O)C2=CC=CC=C21)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file739 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available