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Spectrum Details
HMDB ID:HMDB0037412
Compound Name:3,6-Diglucopyranosyl-4',5,7-trihydroxyflavone
Derivative IUPAC Name:Not Available
Derivative SMILES:C[Si](C)(C)OCC1OC(C2=C(C3=CC=C(O)C=C3)OC3=CC(O)=C(C4OC(CO)C(O)C(O)C4O)C(O)=C3C2=O)C(O)C(O)C1O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 3,6-Diglucopyranosyl-4',5,7-trihydroxyflavone GC-MS (TMS_1_7) - 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:C27H30O15
Molecular Weight (Monoisotopic Mass):594.1585 Da
Derivative Type:TMS_1_7
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)OCC1OC(C2=C(C3=CC=C(O)C=C3)OC3=CC(O)=C(C4OC(CO)C(O)C(O)C4O)C(O)=C3C2=O)C(O)C(O)C1O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file750 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available