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3-exo-5'-(2'-Chloropyridinyl)-8-(ethoxycarbonyl)-8-azabicyclo[3.2.1]octane
SpectraBase Compound ID LNnNhzKdjLD
InChI InChI=1S/C15H19ClN2O3/c1-2-21-14(19)18-11-4-5-12(18)8-15(20,7-11)10-3-6-13(16)17-9-10/h3,6,9,11-12,20H,2,4-5,7-8H2,1H3/t11-,12+,15+
InChIKey SLPRAMHKLMLDEH-JYAVWHMHSA-N
Mol Weight 310.78 g/mol
Molecular Formula C15H19ClN2O3
Exact Mass 310.10842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HW9cDfwyzVV
Name 3-exo-5'-(2'-Chloropyridinyl)-8-(ethoxycarbonyl)-8-azabicyclo[3.2.1]octane
Alternate Name(s) 3-(6-chloro-3-pyridinyl)-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester ethyl 3-(6-chloropyridin-3-yl)-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate ethyl 3-(6-chloro-3-pyridyl)-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate ethyl 3-(6-chloranylpyridin-3-yl)-3-oxidanyl-8-azabicyclo[3.2.1]octane-8-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19ClN2O3
InChI InChI=1S/C15H19ClN2O3/c1-2-21-14(19)18-11-4-5-12(18)8-15(20,7-11)10-3-6-13(16)17-9-10/h3,6,9,11-12,20H,2,4-5,7-8H2,1H3/t11-,12+,15+
InChIKey SLPRAMHKLMLDEH-JYAVWHMHSA-N
Molecular Weight 310.781 g/mol
SMILES O[C@]1(C[C@]2(N([C@@](C1)(CC2)[H])C(=O)OCC)[H])c1cnc(cc1)Cl
SPLASH splash10-02t9-9006000000-141588f055b319278d70
Source of Spectrum J-64-4968-8
Wiley ID 1530558