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9-Oxo-3-((S)-1-phenyl-ethyl)-3-aza-bicyclo[3.3.1]nonane-1-carboxylic acid ethyl ester
SpectraBase Compound ID 241rhCtpJB1
InChI InChI=1S/C19H25NO3/c1-3-23-18(22)19-11-7-10-16(17(19)21)12-20(13-19)14(2)15-8-5-4-6-9-15/h4-6,8-9,14,16H,3,7,10-13H2,1-2H3/t14-,16-,19-/m0/s1
InChIKey XQLQYTDQUSJJHT-QOKNQOGYSA-N
Mol Weight 315.41 g/mol
Molecular Formula C19H25NO3
Exact Mass 315.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUa1rb9a7yt
Name 9-Oxo-3-((S)-1-phenyl-ethyl)-3-aza-bicyclo[3.3.1]nonane-1-carboxylic acid ethyl ester
Alternate Name(s) Ethyl (1R*,5R*)-3-((S)-1-methylbenzyl)-9-oxo-3-azabicyclo[3.3.1]nonane-1-carboxylate Ethyl 9-oxo-3-[(1S)-1-phenylethyl]-3-azabicyclo[3.3.1]nonane-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO3
InChI InChI=1S/C19H25NO3/c1-3-23-18(22)19-11-7-10-16(17(19)21)12-20(13-19)14(2)15-8-5-4-6-9-15/h4-6,8-9,14,16H,3,7,10-13H2,1-2H3/t14-,16-,19-/m0/s1
InChIKey XQLQYTDQUSJJHT-QOKNQOGYSA-N
Molecular Weight 315.413 g/mol
SMILES [C@@]12(C([C@@](CCC2)(CN(C1)[C@](c1ccccc1)(C)[H])[H])=O)C(=O)OCC
SPLASH splash10-0a4i-3943000000-c3d71e37789e2911f229
Source of Spectrum KC-61-5882-7
Wiley ID 1629583