Spectrum Details
MiMe ID:MMDBc0017082
Compound Name:Cephalimysin C
Derivative IUPAC Name:(5S,8S,9R)-8-benzoyl-2-(5-ethylfuran-2-yl)-8-methoxy-3-methyl-6,9-bis[(trimethylsilyl)oxy]-1-oxa-7-azaspiro[4.4]nona-2,6-dien-4-one
Derivative SMILES:CCC1=CC=C(C2=C(C)C(=O)[C@@]3(O2)C(O[Si](C)(C)C)=N[C@@](OC)(C(=O)C2=CC=CC=C2)[C@@H]3O[Si](C)(C)C)O1
Derivative InChIKey:InChIKey=HUURLZQXLAZEJC-FPNNDXFKSA-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:C22H21NO7
Molecular Weight (Monoisotopic Mass):411.1318 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 file776 Bytes
mzML formatted file (MZML)Download file4.63 KB
References