Spectrum Details
MiMe ID:MMDBc0056946
Compound Name:PA(19:0cycw7/16:0)
Derivative IUPAC Name:(2R)-1-({bis[(trimethylsilyl)oxy]phosphoryl}oxy)-3-{[10-(2-hexylcyclopropyl)decanoyl]oxy}propan-2-yl hexadecanoate
Derivative SMILES:CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCC1CC1CCCCCC)COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C
Derivative InChIKey:InChIKey=RYDJXYAOVMVLHZ-SCQKCNBISA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_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:C38H73O8P
Molecular Weight (Monoisotopic Mass):688.5043 Da
Derivative Type:TMS_2_1
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file780 Bytes
mzML formatted file (MZML)Download file4.63 KB
References