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Spectrum Details
HMDB ID:HMDB0267561
Compound Name:PA(i-14:0/20:3(8Z,11Z,14Z)-2OH(5,6))
Derivative IUPAC Name:Not Available
Derivative SMILES:CCCCC/C=C\C/C=C\C/C=C\CC(O[Si](C)(C)C)C(O)CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC(C)C)COP(=O)(O)O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - PA(i-14:0/20:3(8Z,11Z,14Z)-2OH(5,6)) 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:C37H67O10P
Molecular Weight (Monoisotopic Mass):702.4472 Da
Derivative Type:TMS_1_2
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CCCCC/C=C\C/C=C\C/C=C\CC(O[Si](C)(C)C)C(O)CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC(C)C)COP(=O)(O)O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file754 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available