Spectrum Details
MiMe ID:MMDBc0019703
Compound Name:8,9-epibotrydial
Derivative IUPAC Name:(1R,3aR,4S,6R,7aR)-1-formyl-1,3,3,6-tetramethyl-7a-[(trimethylsilyl)oxy]-7-{[(trimethylsilyl)oxy]methylidene}-octahydro-1H-inden-4-yl acetate
Derivative SMILES:CC(=O)O[C@H]1C[C@@H](C)C(=CO[Si](C)(C)C)[C@]2(O[Si](C)(C)C)[C@@H]1C(C)(C)C[C@@]2(C)C=O
Derivative InChIKey:InChIKey=FHZQOBNAEMPDOU-HOWWTGBHSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_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:C17H26O5
Molecular Weight (Monoisotopic Mass):310.178 Da
Derivative Type:TMS_2_1
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file774 Bytes
mzML formatted file (MZML)Download file4.63 KB
References