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2-Azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid, ethyl ester
SpectraBase Compound ID CLAXTA5Gc6d
InChI InChI=1S/C10H15NO2/c1-2-13-10(12)11-7-8-3-5-9(11)6-4-8/h3,5,8-9H,2,4,6-7H2,1H3/t8-,9+/m1/s1
InChIKey LZSYMBPNSZCLIC-BDAKNGLRSA-N
Mol Weight 181.23 g/mol
Molecular Formula C10H15NO2
Exact Mass 181.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D7w8HmmjrJV
Name 2-Azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid, ethyl ester
CAS Registry Number 3693-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-2-13-10(12)11-7-8-3-5-9(11)6-4-8/h3,5,8-9H,2,4,6-7H2,1H3/t8-,9+/m1/s1
InChIKey LZSYMBPNSZCLIC-BDAKNGLRSA-N
Molecular Weight 181.235 g/mol
SMILES C(N1[C@]2(C=C[C@@](C1)(CC2)[H])[H])(=O)OCC
SPLASH splash10-0ue9-8900000000-a7bdf3393cd62aaa6ec5
Source of Spectrum EP-6858-0-0
Synonyms Ethyl 2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate 2-Ethoxycarbonyl-2-azabicyclo[2.2.2]oct-5-ene 5-Azabicyclo[2.2.2]oct-2-ene-5-carboxylic acid ethyl ester Ethyl 5-azabicyclo[2.2.2]oct-2-ene-5-carboxylate
Wiley ID 1177484