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Spectrum Details
T3DB ID:T3D4287
Compound Name:Homogentisic acid
Derivative IUPAC Name:tert-butyldimethylsilyl 2-{2-[(tert-butyldimethylsilyl)oxy]-5-hydroxyphenyl}acetate
Derivative SMILES:CC(C)(C)[Si](C)(C)OC(=O)CC1=CC(O)=CC=C1O[Si](C)(C)C(C)(C)C
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TBDMS_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:C8H8O4
Molecular Weight (Monoisotopic Mass):168.0423 Da
Derivative Type:TBDMS_2_2
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(C)(C)[Si](C)(C)OC(=O)CC1=CC(O)=CC=C1O[Si](C)(C)C(C)(C)C)
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file743 Bytes
mzML formatted file (MZML)Download file4.68 KB
Not Available