Predicted GC-MS Spectrum - GC-MS (TMS_2_6) - 70eV, Positive (YMDB00141)

Spectrum Details
YMDB ID:YMDB00141
Compound Name:ADP-ribose 1"-2" cyclic phosphate
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_6) - 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
Relative Intensity
20406080100
20406080100050100150200250300350400450500550600650700750
050100150200250300350400450500550600650700750
m/z
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:C15H22N5O16P3
Molecular Weight (Monoisotopic Mass):621.0274 Da
Molecular Weight (Avergae Mass):621.2804 Da
Derivative Type:TMS_2_6
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2OC3OP(=O)(O)OC3C2O[Si](C)(C)C)[C@@H](O)[C@H]1O)
Documentation
Document DescriptionDownload
List of m/z values for the spectrumDownload file
mzML formatted fileDownload file
References
Not Available