Spectrum Details
MiMe ID:MMDBc0045747
Compound Name:PE-NMe(12:0/18:0)
Derivative IUPAC Name:[3-(dodecanoyloxy)-2-(octadecanoyloxy)propoxy]({2-[methyl(trimethylsilyl)amino]ethoxy})phosphinic acid
Derivative SMILES:CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COP(=O)(O)OCCN(C)[Si](C)(C)C
Derivative InChIKey:InChIKey=ZMDRVYHSTOBSER-UHFFFAOYNA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_2) - 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:C36H72NO8P
Molecular Weight (Monoisotopic Mass):677.4996 Da
Derivative Type:TMS_1_2
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file769 Bytes
mzML formatted file (MZML)Download file4.63 KB
References