Spectrum Details
MiMe ID:MMDBc0014710
Compound Name:Secobotrydiene-3,4,10,15-tetraol
Derivative IUPAC Name:(2E)-2-[(5S)-2-{2-hydroxy-1-[(trimethylsilyl)oxy]ethyl}-5-(hydroxymethyl)-3,3,5-trimethylcyclopent-1-en-1-yl]but-2-en-1-ol
Derivative SMILES:C/C=C(/CO)C1=C(C(CO)O[Si](C)(C)C)C(C)(C)C[C@]1(C)CO
Derivative InChIKey:InChIKey=HEACGEJEPZJWJM-IDMHSMTPSA-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:C15H26O4
Molecular Weight (Monoisotopic Mass):270.1831 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 file768 Bytes
mzML formatted file (MZML)Download file4.63 KB
References