Spectrum Details
FooDB ID:FDB021632
Compound Name:Quercetin 3-sulfate
Derivative IUPAC Name:Not Available
Derivative SMILES:C[Si](C)(C)OC1=CC=C(C2=C(OS(=O)(=O)O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_5) - 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:C15H10O10S
Molecular Weight (Monoisotopic Mass):381.9995 Da
Derivative Type:TMS_2_5
Predicted by CFM-ID 2.0, energy0
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file765 Bytes
mzML formatted file (MZML)Download file4.63 KB