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Spectrum Details
HMDB ID:HMDB0041433
Compound Name:4,4''-bis(N-feruloyl)serotonin
Derivative IUPAC Name:Not Available
Derivative SMILES:COC1=CC(/C=C/C(=O)NCCC2=C[NH]C3=CC=C(O[Si](C)(C)C)C(C4=C(O)C=CC5=C4C(CCNC(=O)/C=C/C4=CC=C(O)C(OC)=C4)=CN5[Si](C)(C)C)=C23)=CC=C1O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 4,4''-bis(N-feruloyl)serotonin GC-MS (TMS_2_10) - 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:C40H38N4O8
Molecular Weight (Monoisotopic Mass):702.269 Da
Derivative Type:TMS_2_10
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=CC(/C=C/C(=O)NCCC2=C[NH]C3=CC=C(O[Si](C)(C)C)C(C4=C(O)C=CC5=C4C(CCNC(=O)/C=C/C4=CC=C(O)C(OC)=C4)=CN5[Si](C)(C)C)=C23)=CC=C1O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file756 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available