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2-Azabicyclo[2.2.2]octane-2-carboxylic acid, 5-oxo-, ethyl ester
SpectraBase Compound ID CdETuD9TXu2
InChI InChI=1S/C10H15NO3/c1-2-14-10(13)11-6-7-3-4-8(11)5-9(7)12/h7-8H,2-6H2,1H3/t7-,8-/m1/s1
InChIKey GCHPMCMRBLSVMZ-HTQZYQBOSA-N
Mol Weight 197.23 g/mol
Molecular Formula C10H15NO3
Exact Mass 197.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OG5W35h5L5
Name 2-Azabicyclo[2.2.2]octane-2-carboxylic acid, 5-oxo-, ethyl ester
CAS Registry Number 37778-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO3
InChI InChI=1S/C10H15NO3/c1-2-14-10(13)11-6-7-3-4-8(11)5-9(7)12/h7-8H,2-6H2,1H3/t7-,8-/m1/s1
InChIKey GCHPMCMRBLSVMZ-HTQZYQBOSA-N
Molecular Weight 197.234 g/mol
SMILES C(N1C[C@@]2(C(C[C@]1(CC2)[H])=O)[H])(=O)OCC
SPLASH splash10-052b-4900000000-eff94e8494e80c019959
Source of Spectrum EP-6860-0-0
Synonyms Ethyl 5-oxo-2-azabicyclo[2.2.2]octane-2-carboxylate 2-Ethoxycarbonyl-2-azabicyclo[2.2.2]octan-5-one 5-keto-2-azabicyclo[2.2.2]octane-2-carboxylic acid ethyl ester 5-Oxo-2-azabicyclo[2.2.2]octane-2-carboxylic acid ethyl ester Ethyl 5-oxidanylidene-2-azabicyclo[2.2.2]octane-2-carboxylate
Wiley ID 1194416