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exo-2-Aza-2-benzyl-3-ethoxycarbonyl[2.2.2]bicyclooct-5-ene
SpectraBase Compound ID 5PfbQQuMtw5
InChI InChI=1S/C17H21NO2/c1-2-20-17(19)16-14-8-10-15(11-9-14)18(16)12-13-6-4-3-5-7-13/h3-8,10,14-16H,2,9,11-12H2,1H3/t14-,15+,16-/m0/s1
InChIKey FOLMHYFMCKBJSB-XHSDSOJGSA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImveU5Yf5AI
Name exo-2-Aza-2-benzyl-3-ethoxycarbonyl[2.2.2]bicyclooct-5-ene
Alternate Name(s) endo-2-Aza-2-benzyl-3-ethoxycarbonyl[2.2.2]bicyclooct-5-ene 3-(Phenylmethyl)-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid ethyl ester Ethyl 3-benzyl-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylate Ethyl 3-(phenylmethyl)-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-2-20-17(19)16-14-8-10-15(11-9-14)18(16)12-13-6-4-3-5-7-13/h3-8,10,14-16H,2,9,11-12H2,1H3/t14-,15+,16-/m0/s1
InChIKey FOLMHYFMCKBJSB-XHSDSOJGSA-N
Molecular Weight 271.360 g/mol
SMILES [C@]1(N([C@@]2(C=C[C@]1(CC2)[H])[H])Cc1ccccc1)(C(=O)OCC)[H]
SPLASH splash10-006w-3900000000-fe6a1c9e51e4d4181297
Source of Spectrum QC-2-1275-0
Wiley ID 883025