Spectrum Details
MiMe ID:MMDBc0054905
Compound Name:(3R)-7,8-dihydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Derivative IUPAC Name:trimethylsilyl (3R)-7-hydroxy-8-[(trimethylsilyl)oxy]-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
Derivative SMILES:C[Si](C)(C)OC(=O)[C@H]1CC2=CC=C(O)C(O[Si](C)(C)C)=C2CN1
Derivative InChIKey:InChIKey=SYBVIYQMCNIQGF-CYBMUJFWSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_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:C10H11NO4
Molecular Weight (Monoisotopic Mass):209.0688 Da
Derivative Type:TMS_2_2
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file764 Bytes
mzML formatted file (MZML)Download file4.63 KB
References