Spectrum Details
MiMe ID:MMDBc0054086
Compound Name:(R)-(2,4-dichlorophenoxy)propanoic acid
Derivative IUPAC Name:trimethylsilyl (2R)-2-(2,4-dichlorophenoxy)propanoate
Derivative SMILES:C[C@@H](OC1=CC=C(Cl)C=C1Cl)C(=O)O[Si](C)(C)C
Derivative InChIKey:InChIKey=UIFSXGDSARSNLB-MRVPVSSYSA-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:C9H8Cl2O3
Molecular Weight (Monoisotopic Mass):233.985 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 file771 Bytes
mzML formatted file (MZML)Download file4.63 KB
References