Spectrum Details
MiMe ID:MMDBc0018784
Compound Name:Kanamycin B
Derivative IUPAC Name:(2S,3R,4R,5S,6R)-4-amino-2-{[(1S,2S,3R,4S,6R)-4,6-diamino-3-{[(2R,3R,4R,5R,6R)-6-(aminomethyl)-3-[bis(trimethylsilyl)amino]-5-hydroxy-4-[(trimethylsilyl)oxy]oxan-2-yl]oxy}-2-hydroxycyclohexyl]oxy}-5-[(trimethylsilyl)oxy]-6-{[(trimethylsilyl)oxy]methyl}oxan-3-ol
Derivative SMILES:C[Si](C)(C)OC[C@H]1O[C@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3N([Si](C)(C)C)[Si](C)(C)C)[C@@H](N)C[C@H]2N)[C@H](O)[C@@H](N)[C@@H]1O[Si](C)(C)C
Derivative InChIKey:InChIKey=YTEOSVZYTCNJTH-YZYGMGKBSA-N
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_5_244) - 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:C18H37N5O10
Molecular Weight (Monoisotopic Mass):483.254 Da
Derivative Type:TMS_5_244
Notes
Predicted by CFM-ID 2.0, energy0
Documentation
Document DescriptionDownloadFile Size
Generated list of m/z values for the spectrum (TSV)Download file781 Bytes
mzML formatted file (MZML)Download file4.64 KB
References