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Spectrum Details
HMDB ID:HMDB0006888
Compound Name:5b-Cyprinol sulfate
Derivative IUPAC Name:Not Available
Derivative SMILES:CC(CCCC(CO)COS(=O)(=O)O[Si](C)(C)C)C1CCC2C3C(C[C@@H](O)[C@]12C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)CC1C[C@H]3O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 5b-Cyprinol sulfate GC-MS (TMS_2_9) - 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:C27H48O8S
Molecular Weight (Monoisotopic Mass):532.307 Da
Derivative Type:TMS_2_9
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(CCCC(CO)COS(=O)(=O)O[Si](C)(C)C)C1CCC2C3C(C[C@@H](O)[C@]12C)[C@@]1(C)CC[C@@H](O[Si](C)(C)C)CC1C[C@H]3O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file763 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available