Spectrum Details
MiMe ID:MMDBc0049956
Compound Name:2,3,4,5-Tetrahydrodipicolinate
Derivative IUPAC Name:(6S)-6-{[(trimethylsilyl)oxy]carbonyl}-3,4,5,6-tetrahydropyridine-2-carboxylic acid
Derivative SMILES:C[Si](C)(C)OC(=O)[C@@H]1CCCC(C(=O)O)=N1
Derivative InChIKey:InChIKey=JKUFUUADGZSOGO-QMMMGPOBSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (1 TMS) - 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:C10H17NO4Si
Molecular Weight (Monoisotopic Mass):243.093 Da
Derivative Type:1 TMS
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)OC(=O)[C@@H]1CCCC(C(=O)O)=N1)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file749 Bytes
mzML formatted file (MZML)Download file4.67 KB
References
Not Available