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2-Azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid, 3-phenyl-, ethyl ester
SpectraBase Compound ID HqPWwOjPklh
InChI InChI=1S/C16H19NO2/c1-2-19-16(18)17-14-10-8-13(9-11-14)15(17)12-6-4-3-5-7-12/h3-8,10,13-15H,2,9,11H2,1H3/t13-,14+,15?/m1/s1
InChIKey VCOOGUSZYTZSTK-GNXJLENFSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3o9u7IMfcO
Name 2-Azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid, 3-phenyl-, ethyl ester
CAS Registry Number 3693-55-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c1-2-19-16(18)17-14-10-8-13(9-11-14)15(17)12-6-4-3-5-7-12/h3-8,10,13-15H,2,9,11H2,1H3/t13-,14+,15?/m1/s1
InChIKey VCOOGUSZYTZSTK-GNXJLENFSA-N
Molecular Weight 257.333 g/mol
SMILES CCOC(N1[C@@]2(CC[C@@](C=C2)(C1c1ccccc1)[H])[H])=O
SPLASH splash10-0059-5910000000-59dbb33c90996b34b477
Source of Spectrum EP-6859-0-0
Synonyms Ethyl 3-phenyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate 2-Phenyl-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylic acid ethyl ester Ethyl 2-phenyl-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate
Wiley ID 1260911