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N-(ethoxycarbonyl)-3-exo-propyl-2-azabicyclo[2.2.2]oct-5-ene
SpectraBase Compound ID FeArpI7ih9T
InChI InChI=1S/C13H21NO2/c1-3-5-12-10-6-8-11(9-7-10)14(12)13(15)16-4-2/h6,8,10-12H,3-5,7,9H2,1-2H3
InChIKey QYOZGVHGMIFSDN-UHFFFAOYSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ASSffVRRWpW
Name N-(ethoxycarbonyl)-3-exo-propyl-2-azabicyclo[2.2.2]oct-5-ene
CAS Registry Number 83187-91-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-3-5-12-10-6-8-11(9-7-10)14(12)13(15)16-4-2/h6,8,10-12H,3-5,7,9H2,1-2H3
InChIKey QYOZGVHGMIFSDN-UHFFFAOYSA-N
Molecular Weight 223.316 g/mol
SMILES C(N1C(C2C=CC1CC2)CCC)(=O)OCC
SPLASH splash10-0f89-4900000000-5dd38f451442473cccbf
Source of Spectrum J-50-1893-3
Synonyms Ethyl 3-propyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate
Wiley ID 1224086