Spectrum Details
FooDB ID:FDB001532
Compound Name:Betulinic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O[Si](C)(C)C(C)(C)C)C(C)(C)C5CCC43C)C12
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TBDMS_1_1) - 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:C30H48O3
Molecular Weight (Monoisotopic Mass):456.3603 Da
Derivative Type:TBDMS_1_1
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(O[Si](C)(C)C(C)(C)C)C(C)(C)C5CCC43C)C12)
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file757 Bytes
mzML formatted file (MZML)Download file4.67 KB
Not Available