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7-exo-4-Chloro-7(8)-ethoxy-2-phenyl-2,5-diazabicyclo[2.2.2]octane-3-one isomer
SpectraBase Compound ID LZkLHwXQQWH
InChI InChI=1S/C14H17ClN2O2/c1-2-19-12-8-14(15)13(18)17(11(12)9-16-14)10-6-4-3-5-7-10/h3-7,11-12,16H,2,8-9H2,1H3/t11-,12?,14+/m1/s1
InChIKey GHCDAESRMBSJPB-SOGVLRHJSA-N
Mol Weight 280.75 g/mol
Molecular Formula C14H17ClN2O2
Exact Mass 280.097855 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tlQzg8RhKa
Name 7-exo-4-Chloro-7(8)-ethoxy-2-phenyl-2,5-diazabicyclo[2.2.2]octane-3-one isomer
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Formula C14H17ClN2O2
InChI InChI=1S/C14H17ClN2O2/c1-2-19-12-8-14(15)13(18)17(11(12)9-16-14)10-6-4-3-5-7-10/h3-7,11-12,16H,2,8-9H2,1H3/t11-,12?,14+/m1/s1
InChIKey GHCDAESRMBSJPB-SOGVLRHJSA-N
Molecular Weight 280.755 g/mol
SMILES N1C[C@]2(N(C([C@@]1(CC2OCC)Cl)=O)c1ccccc1)[H]
SPLASH splash10-0a6r-9770000000-a67432ab318da90af9e8
Source of Spectrum KC-57-3216-12
Synonyms 7-endo-4-Chloro-7(8)-ethoxy-2-phenyl-2,5-diazabicyclo[2.2.2]octane-3-one isomer
Wiley ID 1623752