Spectrum Details
MiMe ID:MMDBc0012186
Compound Name:12-methoxy sordariol
Derivative IUPAC Name:3-[(1E,3S,4R)-4-hydroxy-3-[(trimethylsilyl)oxy]pent-1-en-1-yl]-2-(methoxymethyl)phenol
Derivative SMILES:COCC1=C(O)C=CC=C1/C=C/[C@H](O[Si](C)(C)C)[C@@H](C)O
Derivative InChIKey:InChIKey=TYNKXQAXLFYREH-UFIQAVOQSA-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:C13H18O4
Molecular Weight (Monoisotopic Mass):238.1205 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 file772 Bytes
mzML formatted file (MZML)Download file4.63 KB
References