Spectrum Details
MiMe ID:MMDBc0011188
Compound Name:Globosuxanthone B
Derivative IUPAC Name:methyl (1R,2R,3S)-2,8-dihydroxy-3-methoxy-9-oxo-1-[(trimethylsilyl)oxy]-2,3,4,9-tetrahydro-1H-xanthene-1-carboxylate
Derivative SMILES:COC(=O)[C@@]1(O[Si](C)(C)C)C2=C(C[C@H](OC)[C@H]1O)OC1=CC=CC(O)=C1C2=O
Derivative InChIKey:InChIKey=UKVVTSKRODOPEI-BOFPYLFWSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_2) - 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:C16H16O8
Molecular Weight (Monoisotopic Mass):336.0845 Da
Derivative Type:TMS_1_2
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file770 Bytes
mzML formatted file (MZML)Download file4.63 KB
References