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1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 5-oxo-, ethyl ester
SpectraBase Compound ID 8w3g05JgBKZ
InChI InChI=1S/C10H15NO3/c1-2-14-10(13)8-5-7-3-4-11(8)6-9(7)12/h7-8H,2-6H2,1H3/t7-,8?/m1/s1
InChIKey VUSQAOWTWXHDRE-GVHYBUMESA-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 3kCvetKBYr2
Name 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 5-oxo-, ethyl ester
CAS Registry Number 22207-79-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO3
InChI InChI=1S/C10H15NO3/c1-2-14-10(13)8-5-7-3-4-11(8)6-9(7)12/h7-8H,2-6H2,1H3/t7-,8?/m1/s1
InChIKey VUSQAOWTWXHDRE-GVHYBUMESA-N
Molecular Weight 197.234 g/mol
SMILES C(OCC)(=O)C1N2CC([C@@](C1)(CC2)[H])=O
SPLASH splash10-0007-9000000000-dc7dd3dcaf94e18b6627
Source of Spectrum O-3-1026-3
Synonyms Ethyl 5-oxoquinuclidine-2-carboxylate 2-Quinuclidinecarboxylic acid, 5-oxo-, ethyl ester 5-ketoquinuclidine-2-carboxylic acid ethyl ester 5-Oxo-1-azabicyclo[2.2.2]octane-2-carboxylic acid ethyl ester Ethyl 5-oxidanylidene-1-azabicyclo[2.2.2]octane-2-carboxylate Ethyl 5-oxo-1-azabicyclo[2.2.2]octane-2-carboxylate Ethyl 5-quinuclidone-2-carboxylate
Wiley ID 1194415