Hmdb loader
Spectrum Details
HMDB ID:HMDB0034518
Compound Name:Theasapogenol E
Derivative IUPAC Name:Not Available
Derivative SMILES:CC1(C)CC2C3=CCC4C5(C)CCC(O[Si](C)(C)C)C(C)(C=O)C5CCC4(C)C3(C)CC(O[Si](C)(C)C)C2(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - Theasapogenol E GC-MS (TMS_4_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:C30H48O6
Molecular Weight (Monoisotopic Mass):504.3451 Da
Derivative Type:TMS_4_2
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC1(C)CC2C3=CCC4C5(C)CCC(O[Si](C)(C)C)C(C)(C=O)C5CCC4(C)C3(C)CC(O[Si](C)(C)C)C2(CO[Si](C)(C)C)C(O)C1O[Si](C)(C)C)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file757 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available