Spectrum Details
MiMe ID:MMDBc0003357
Compound Name:Aspernidine A
Derivative IUPAC Name:5-methoxy-6-{[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]oxy}-7-[(trimethylsilyl)oxy]-1H-isoindol-3-ol
Derivative SMILES:COC1=CC2=C(CN=C2O)C(O[Si](C)(C)C)=C1OC/C=C(\C)CC/C=C(\C)CCC=C(C)C
Derivative InChIKey:InChIKey=TVKQZQGVGXPXLQ-RSKMIKRQSA-N
Spectrum Type:Predicted GC-MS Spectrum - 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:C24H33NO4
Molecular Weight (Monoisotopic Mass):399.241 Da
Derivative Type:TMS_1_2
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