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Ecognine Methyl Ester
SpectraBase Compound ID 17XVtxtZnq3
InChI InChI=1S/C10H17NO3/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2/h6-9,12H,3-5H2,1-2H3/t6-,7+,8-,9+/m0/s1
InChIKey QIQNNBXHAYSQRY-UYXSQOIJSA-N
Mol Weight 199.25 g/mol
Molecular Formula C10H17NO3
Exact Mass 199.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F42f4NbUESw
Name Ecognine Methyl Ester
Alternate Name(s) Methyl 3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate Methyl ecgonine Methyl (1R,2R,3S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
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Formula C10H17NO3
InChI InChI=1S/C10H17NO3/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2/h6-9,12H,3-5H2,1-2H3/t6-,7+,8-,9+/m0/s1
InChIKey QIQNNBXHAYSQRY-UYXSQOIJSA-N
Molecular Weight 199.250 g/mol
SMILES O[C@]1(C[C@@]2([H])N([C@]([C@]1(C(=O)OC)[H])([H])CC2)C)[H]
SPLASH splash10-001m-9100000000-f019047e7200f02b2bcc
Source of Spectrum SWG-33-3110-0
Wiley ID 1810033