Spectrum Details
MiMe ID:MMDBc0017117
Compound Name:Chaetomugilin M
Derivative IUPAC Name:(6aS,9aR)-5-chloro-9-[(5R,6R)-2,2,5,6,8,8-hexamethyl-3,7-dioxa-2,8-disilanonan-4-ylidene]-3-[(1E,3R,4R)-4-hydroxy-3-methylpent-1-en-1-yl]-6a-methyl-6H,6aH,8H,9H,9aH-furo[2,3-h]isochromene-6,8-dione
Derivative SMILES:C[C@@H](O)[C@H](C)/C=C/C1=CC2=C(Cl)C(=O)[C@@]3(C)OC(=O)C(=C(O[Si](C)(C)C)[C@H](C)[C@@H](C)O[Si](C)(C)C)[C@H]3C2=CO1
Derivative InChIKey:InChIKey=UCYIDHROHAMCHJ-LRUVEIBUSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_5) - 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:C23H27ClO7
Molecular Weight (Monoisotopic Mass):450.1445 Da
Derivative Type:TMS_2_5
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file782 Bytes
mzML formatted file (MZML)Download file4.63 KB
References