Spectrum Details
MiMe ID:MMDBc0048267
Compound Name:2-Hydroxy-3-keto-5-methylthiopentenyl-1-phosphate
Derivative IUPAC Name:5-(methylsulfanyl)-2,3-bis[(trimethylsilyl)oxy]penta-1,3-dien-1-yl ditrimethylsilyl phosphate
Derivative SMILES:CSCC=C(O[Si](C)(C)C)C(=COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
Derivative InChIKey:InChIKey=YLJNCCQGMTXGEX-UHFFFAOYSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_4_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:C6H11O6PS
Molecular Weight (Monoisotopic Mass):242.0014 Da
Derivative Type:TMS_4_1
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file766 Bytes
mzML formatted file (MZML)Download file4.63 KB
References