Spectrum Details
MiMe ID:MMDBc0031243
Compound Name:PE(10:0(3-OH)/17:0cycw7c)
Derivative IUPAC Name:(2R)-3-[({2-[bis(trimethylsilyl)amino]ethoxy}[(trimethylsilyl)oxy]phosphoryl)oxy]-2-{[8-(2-hexylcyclopropyl)octanoyl]oxy}propyl 3-hydroxydecanoate
Derivative SMILES:CCCCCCCC(O)CC(=O)OC[C@H](COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)OC(=O)CCCCCCCC1CC1CCCCCC
Derivative InChIKey:InChIKey=ZNGVCTAMADBJBL-JQLPJCAHSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_3_3) - 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:C32H62NO9P
Molecular Weight (Monoisotopic Mass):635.4162 Da
Derivative Type:TMS_3_3
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file773 Bytes
mzML formatted file (MZML)Download file4.63 KB
References