Spectrum Details
MiMe ID:MMDBc0047915
Compound Name:Phosphoribosylformylglycinamidine
Derivative IUPAC Name:{[(2R,3S,4R,5R)-3-[(tert-butyldimethylsilyl)oxy]-5-[N-(carbamimidoylmethyl)formamido]-4-hydroxyoxolan-2-yl]methoxy}phosphonic acid
Derivative SMILES:CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O)O[C@@H](N(C=O)CC(=N)N)[C@@H]1O
Derivative InChIKey:InChIKey=AOKUYOMEOYTZLP-OJAKKHQRSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TBDMS_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:C8H16N3O8P
Molecular Weight (Monoisotopic Mass):313.0675 Da
Derivative Type:TBDMS_1_1
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COP(=O)(O)O)O[C@@H](N(C=O)CC(=N)N)[C@@H]1O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file745 Bytes
mzML formatted file (MZML)Download file4.67 KB
References
Not Available