Spectrum Details
MiMe ID:MMDBc0022735
Compound Name:Asperterpene G
Derivative IUPAC Name:methyl (2S,4aS,4bS,6aS,10aS,10bS,12aS)-5-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,8-trioxo-6-[(trimethylsilyl)oxy]-1H,2H,4H,4aH,4bH,6aH,7H,8H,9H,10H,10aH,10bH,11H,12H,12aH-phenanthro[1,2-c]pyran-2-carboxylate
Derivative SMILES:C=C1C[C@H]2[C@]3(C)CCC(=O)C(C)(C)[C@H]3C(O[Si](C)(C)C)=C(O)[C@]2(C)[C@@H]2C(=O)O[C@](C)(C(=O)OC)C(=O)[C@]12C
Derivative InChIKey:InChIKey=PGWTXXVZCFFTFR-KYWXAUTFSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_3) - 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:C26H34O8
Molecular Weight (Monoisotopic Mass):474.2254 Da
Derivative Type:TMS_1_3
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file778 Bytes
mzML formatted file (MZML)Download file4.63 KB
References