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(2E)-2-(4-Nitrobenzylidene)-1-azabicyclo[2.2.2]octan-3-one
SpectraBase Compound ID uOairbwRiC
InChI InChI=1S/C14H14N2O3/c17-14-11-5-7-15(8-6-11)13(14)9-10-1-3-12(4-2-10)16(18)19/h1-4,9,11H,5-8H2/b13-9+
InChIKey WYLOZSIGADKNRC-UKTHLTGXSA-N
Mol Weight 258.28 g/mol
Molecular Formula C14H14N2O3
Exact Mass 258.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 86YG1wFmpLW
Name (2E)-2-(4-Nitrobenzylidene)-1-azabicyclo[2.2.2]octan-3-one
CAS Registry Number 79331-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O3
InChI InChI=1S/C14H14N2O3/c17-14-11-5-7-15(8-6-11)13(14)9-10-1-3-12(4-2-10)16(18)19/h1-4,9,11H,5-8H2/b13-9+
InChIKey WYLOZSIGADKNRC-UKTHLTGXSA-N
Molecular Weight 258.277 g/mol
SMILES C1(\C(N2CCC1CC2)=C/c1ccc(cc1)N(=O)=O)=O
SPLASH splash10-000x-9630000000-9557131791a7dc5e31fd
Source of Spectrum AD-0-2532-0
Synonyms (2E)-2-(4-nitrobenzylidene)quinuclidin-3-one (2E)-2-[(4-nitrophenyl)methylene]quinuclidin-3-one (2E)-2-[(4-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-one Azabicyclo[2.2.2]octan-3-one, 2-[(4-nitrophenyl)methylene]- Quinulcidin-3-one, 2-(4-nitrobenzylideno)-
Wiley ID 1423714