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Spectrum Details
HMDB ID:HMDB0039263
Compound Name:Tercatain
Derivative IUPAC Name:Not Available
Derivative SMILES:C[Si](C)(C)OC1=C(O)C(O)=CC2=C1C1=C(C=C(O)C(O)=C1O)C(=O)OCC1OC(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(O)C(OC2=O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - Tercatain GC-MS (TMS_1_7) - 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:C34H26O22
Molecular Weight (Monoisotopic Mass):786.0916 Da
Derivative Type:TMS_1_7
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)OC1=C(O)C(O)=CC2=C1C1=C(C=C(O)C(O)=C1O)C(=O)OCC1OC(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(O)C(OC2=O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file749 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available