Spectrum Details
MiMe ID:MMDBc0000759
Compound Name:LysoPG(18:1(9Z)/0:0)
Derivative IUPAC Name:(2R)-3-({[(2S)-2,3-bis[(trimethylsilyl)oxy]propoxy][(trimethylsilyl)oxy]phosphoryl}oxy)-2-hydroxypropyl (9Z)-octadec-9-enoate
Derivative SMILES:CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(OC[C@H](CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
Derivative InChIKey:InChIKey=WRURZOGMMZTLTA-QEBKBTEFSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_3_4) - 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:C24H47O9P
Molecular Weight (Monoisotopic Mass):510.2958 Da
Derivative Type:TMS_3_4
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