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Spectrum Details
Compound Name:4,4-dimethyl-5alpha-cholesta-8,14-dien-3beta-ol
Derivative IUPAC Name:Not Available
Derivative SMILES:CC(C)CCC[C@@H](C)[C@H]1CC=C2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C)C(C)(C)[C@@H]1CC3
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 4,4-dimethyl-5alpha-cholesta-8,14-dien-3beta-ol GC-MS (1 TMS) - 70eV, Positive
Splash Key:splash10-06di-3103900000-01bc2923151262e134cf
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:C32H56OSi
Molecular Weight (Monoisotopic Mass):484.41 Da
Derivative Type:1 TMS
Predicted by CFMID-EI, Ionization energy 70 eV fully TMS-derivatized (structure: CC(C)CCC[C@@H](C)[C@H]1CC=C2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O[Si](C)(C)C)C(C)(C)[C@@H]1CC3)
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file1.53 KB
Generated list of m/z values for the spectrum (TXT)Download file1.53 KB
mzML formatted file (MZML)Download file4.66 KB
  1. Allen F, Pon A, Greiner R, Wishart D: Computational Prediction of Electron Ionization Mass Spectra to Assist in GC/MS Compound Identification. Anal Chem. 2016 Aug 2;88(15):7689-97. doi: 10.1021/acs.analchem.6b01622. Epub 2016 Jul 21. [PubMed: 27381172 ]