Spectrum Details
MiMe ID:MMDBc0022870
Compound Name:Colletopyrandione
Derivative IUPAC Name:3-(3-hydroxy-3-methyl-3H-indol-2-yl)-5,6-dimethyl-4-[(trimethylsilyl)oxy]-2H-pyran-2-one
Derivative SMILES:CC1=C(C)C(O[Si](C)(C)C)=C(C2=NC3=CC=CC=C3C2(C)O)C(=O)O1
Derivative InChIKey:InChIKey=DWFGQDHDFAGACB-UHFFFAOYNA-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:C16H15NO4
Molecular Weight (Monoisotopic Mass):285.1001 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 file768 Bytes
mzML formatted file (MZML)Download file4.63 KB
References