Spectrum Details
MiMe ID:MMDBc0023893
Compound Name:Alternapyrone B
Derivative IUPAC Name:2-(6-{3,5-dimethyl-2-oxo-4-[(trimethylsilyl)oxy]-2H-pyran-6-yl}-2,4-dimethylhepta-1,3-dien-1-yl)-6,8-dimethyldec-6-enoic acid
Derivative SMILES:CCC(C)C=C(C)CCCC(C=C(C)C=C(C)CC(C)C1=C(C)C(O[Si](C)(C)C)=C(C)C(=O)O1)C(=O)O
Derivative InChIKey:InChIKey=JRJPRROIXHDLNX-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:C28H42O5
Molecular Weight (Monoisotopic Mass):458.3032 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 file773 Bytes
mzML formatted file (MZML)Download file4.63 KB
References