Spectrum Details
MiMe ID:MMDBc0045748
Compound Name:PE-NMe(15:0/18:1(9Z))
Derivative IUPAC Name:1-({[2-(methylamino)ethoxy][(trimethylsilyl)oxy]phosphoryl}oxy)-3-(pentadecanoyloxy)propan-2-yl (9Z)-octadec-9-enoate
Derivative SMILES:CCCCCCCC/C=C\CCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCC)COP(=O)(OCCNC)O[Si](C)(C)C
Derivative InChIKey:InChIKey=CRAGFRQJFZIKFF-DQRAZIAONA-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:C39H76NO8P
Molecular Weight (Monoisotopic Mass):717.5309 Da
Derivative Type:TMS_1_1
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file772 Bytes
mzML formatted file (MZML)Download file4.63 KB
References