Spectrum Details
T3DB ID:T3D2701
Compound Name:Pyridoxine
Derivative IUPAC Name:4-(hydroxymethyl)-2-methyl-5-{[(trimethylsilyl)oxy]methyl}pyridin-3-ol
Derivative SMILES:CC1=NC=C(CO[Si](C)(C)C)C(CO)=C1O
Derivative InChIKey:InChIKey=MURLSRHORHRQPQ-UHFFFAOYSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_3) - 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:C8H11NO3
Molecular Weight (Monoisotopic Mass):169.0739 Da
Derivative Type:TMS_1_3
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC1=NC=C(CO[Si](C)(C)C)C(CO)=C1O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file740 Bytes
mzML formatted file (MZML)Download file4.68 KB
References
Not Available