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(E)-(S)-1-Benzyl-2-oxo-2,3,4,7,8,9-hexahydro-1H-azonine-4-carboxylic acid ethyl ester
SpectraBase Compound ID BJhWdmJiVR9
InChI InChI=1S/C18H23NO3/c1-2-22-18(21)16-11-7-4-8-12-19(17(20)13-16)14-15-9-5-3-6-10-15/h3,5-7,9-11,16H,2,4,8,12-14H2,1H3/b11-7+/t16-/m1/s1
InChIKey HSPFXYYCVRNFDW-AYAUWGRQSA-N
Mol Weight 301.39 g/mol
Molecular Formula C18H23NO3
Exact Mass 301.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfBpmiINOA0
Name (E)-(S)-1-Benzyl-2-oxo-2,3,4,7,8,9-hexahydro-1H-azonine-4-carboxylic acid ethyl ester
Alternate Name(s) (3S)-1-Benzyl-4-ethoxycarbonyl-2(6H)-azoninone (3S)-1-Benzyl-4-ethoxycarbonyl-2,3,4,7,8,9-hexahydro-2-azoninone Ethyl (4S)-1-benzyl-2-oxo-2,3,4,7,8,9-hexahydro-1H-azonine-4-carboxylate
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Formula C18H23NO3
InChI InChI=1S/C18H23NO3/c1-2-22-18(21)16-11-7-4-8-12-19(17(20)13-16)14-15-9-5-3-6-10-15/h3,5-7,9-11,16H,2,4,8,12-14H2,1H3/b11-7+/t16-/m1/s1
InChIKey HSPFXYYCVRNFDW-AYAUWGRQSA-N
Molecular Weight 301.386 g/mol
SMILES C1(N(Cc2ccccc2)CCC\C=C\[C@@](C(=O)OCC)(C1)[H])=O
SPLASH splash10-0006-9121000000-157bd94d11e326caed61
Source of Spectrum QE-2-898-14
Wiley ID 842617