Spectrum Details
MiMe ID:MMDBc0033221
Compound Name:Cer 20:0;3/26:0;1
Derivative IUPAC Name:(9R)-N-[(2S,3S,4R)-1,3,4-trihydroxyicosan-2-yl]-9-[(trimethylsilyl)oxy]hexacosanamide
Derivative SMILES:CCCCCCCCCCCCCCCCC[C@H](CCCCCCCC(=O)N[C@@H](CO)[C@H](O)[C@H](O)CCCCCCCCCCCCCCCC)O[Si](C)(C)C
Derivative InChIKey:InChIKey=SLCKSYNYINNZSR-DVJOCVAOSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_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:C46H93NO5
Molecular Weight (Monoisotopic Mass):739.7054 Da
Derivative Type:TMS_1_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