Spectrum Details
CDB ID:CDB005082
Compound Name:Fructose 6-phosphate
Derivative IUPAC Name:{[(2R,3R,4S)-2,3,4-trihydroxy-5-oxo-6-[(trimethylsilyl)oxy]hexyl]oxy}phosphonic acid
Derivative SMILES:C[Si](C)(C)OCC(=O)[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O
Derivative InChIKey:InChIKey=ILQBAMAWIRLSGY-FTLITQJKSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_1) - 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:C6H13O9P
Molecular Weight (Monoisotopic Mass):260.0297 Da
Derivative Type:TMS_1_1
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)OCC(=O)[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file750 Bytes
mzML formatted file (MZML)Download file4.68 KB
References
Not Available