Spectrum Details
MiMe ID:MMDBc0017529
Compound Name:Sch 210792
Derivative IUPAC Name:trimethylsilyl (2R)-3-[(3Z)-3-{[(1S,2R,4aS,6R,8S,8aR)-2-[(2E)-but-2-en-2-yl]-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl](hydroxy)methylidene}-2-hydroxy-4-[(trimethylsilyl)oxy]-3H-pyrrol-5-yl]-2-hydroxy-2-methylpropanoate
Derivative SMILES:C/C=C(\C)[C@@H]1C=C[C@@H]2C[C@H](C)C[C@H](C)[C@H]2[C@@H]1/C(O)=C1/C(O)=NC(C[C@@](C)(O)C(=O)O[Si](C)(C)C)=C1O[Si](C)(C)C
Derivative InChIKey:InChIKey=OWOSDEVIRIKGII-FBKKMBMPSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_2_10) - 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:C25H35NO6
Molecular Weight (Monoisotopic Mass):445.2464 Da
Derivative Type:TMS_2_10
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file772 Bytes
mzML formatted file (MZML)Download file4.64 KB
References