Hmdb loader
Spectrum Details
HMDB ID:HMDB0254457
Compound Name:Meproscillarin
Derivative IUPAC Name:Not Available
Derivative SMILES:COC1C(C)OC(OC2C=C3CCC4C(CCC5(C)C(C6=COC(=O)C=C6)CCC45O[Si](C)(C)C)C3(C)CC2)C(O)C1O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - Meproscillarin GC-MS (TMS_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:C31H44O8
Molecular Weight (Monoisotopic Mass):544.3036 Da
Derivative Type:TMS_1_1
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1C(C)OC(OC2C=C3CCC4C(CCC5(C)C(C6=COC(=O)C=C6)CCC45O[Si](C)(C)C)C3(C)CC2)C(O)C1O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file755 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available