Spectrum Details
MiMe ID:MMDBc0047915
Compound Name:Phosphoribosylformylglycinamidine
Derivative IUPAC Name:{[(2R,3S,4R,5R)-5-(N-{[N,N'-bis(trimethylsilyl)carbamimidoyl]methyl}formamido)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
Derivative SMILES:C[Si](C)(C)N=C(CN(C=O)[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O)N[Si](C)(C)C
Derivative InChIKey:InChIKey=PBFQOMMYRXIGFA-FMKGYKFTSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_12) - 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:C8H16N3O8P
Molecular Weight (Monoisotopic Mass):313.0675 Da
Derivative Type:TMS_2_12
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)N=C(CN(C=O)[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O)N[Si](C)(C)C)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file757 Bytes
mzML formatted file (MZML)Download file4.67 KB
References
Not Available