Spectrum Details
MiMe ID:MMDBc0004172
Compound Name:Bicycloalternarene 5
Derivative IUPAC Name:{[4-methoxy-6-({2-methyl-5-[(2Z)-6-methylhepta-2,5-dien-2-yl]-2-[(trimethylsilyl)oxy]cyclopentyl}methyl)-5-[(trimethylsilyl)oxy]cyclohexa-1,5-dien-1-yl]oxy}trimethylsilane
Derivative SMILES:COC1CC=C(O[Si](C)(C)C)C(CC2C(/C(C)=C\CC=C(C)C)CCC2(C)O[Si](C)(C)C)=C1O[Si](C)(C)C
Derivative InChIKey:InChIKey=ILVJZKZHXSZKOJ-ULJHMMPZNA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_3_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:C22H34O4
Molecular Weight (Monoisotopic Mass):362.2457 Da
Derivative Type:TMS_3_1
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file784 Bytes
mzML formatted file (MZML)Download file4.63 KB
References