Spectrum Details
MiMe ID:MMDBc0054779
Compound Name:(1S,4R)-1-hydroxylimonen-2-one
Derivative IUPAC Name:(1S,4R)-1-methyl-4-(prop-1-en-2-yl)-2-[(trimethylsilyl)oxy]cyclohex-2-en-1-ol
Derivative SMILES:C=C(C)[C@H]1C=C(O[Si](C)(C)C)[C@@](C)(O)CC1
Derivative InChIKey:InChIKey=YVTARGOXRQPFHJ-YPMHNXCESA-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:C10H16O2
Molecular Weight (Monoisotopic Mass):168.115 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 file771 Bytes
mzML formatted file (MZML)Download file4.63 KB
References