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6-Methyl-6,7-dihydroxy-8-[2',5'-dimethyl-6'-hydroxyhexylidene]-1-azabicyclo[3.4.0]nonane
SpectraBase Compound ID FISEkmPwPGW
InChI InChI=1S/C17H31NO3/c1-12(6-7-13(2)11-19)9-14-10-18-8-4-5-15(18)17(3,21)16(14)20/h9,12-13,15-16,19-21H,4-8,10-11H2,1-3H3/b14-9-
InChIKey QLQHWTGMAOUQIT-ZROIWOOFSA-N
Mol Weight 297.44 g/mol
Molecular Formula C17H31NO3
Exact Mass 297.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26FhUrdYIzA
Name 6-Methyl-6,7-dihydroxy-8-[2',5'-dimethyl-6'-hydroxyhexylidene]-1-azabicyclo[3.4.0]nonane
Alternate Name(s) (6Z)-6-(6-hydroxy-2,5-dimethylhexylidene)-8-methyloctahydro-7,8-indolizinediol 6-Methyl-6,7-dihydroxy-8-[2',5'-dimethyl-6'-hydroxyhexylidene]-1-azabicyclo[4.3.0]nonane Allopumiliotoxin
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Formula C17H31NO3
InChI InChI=1S/C17H31NO3/c1-12(6-7-13(2)11-19)9-14-10-18-8-4-5-15(18)17(3,21)16(14)20/h9,12-13,15-16,19-21H,4-8,10-11H2,1-3H3/b14-9-
InChIKey QLQHWTGMAOUQIT-ZROIWOOFSA-N
Molecular Weight 297.439 g/mol
SMILES OC1(C(\C(CN2C1CCC2)=C/C(CCC(CO)C)C)O)C
SPLASH splash10-00di-9510000000-d278d284ead12f241e74
Source of Spectrum X2-68-1556-1575
Wiley ID 1610255