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(3S,4R)-4-Ethoxycarbonyl-1-methyl-3-phenyl-2(6H)-azoninone
SpectraBase Compound ID 2T4T0uEgCdE
InChI InChI=1S/C18H23NO3/c1-3-22-18(21)15-12-8-5-9-13-19(2)17(20)16(15)14-10-6-4-7-11-14/h4,6-8,10-12,15-16H,3,5,9,13H2,1-2H3/b12-8+/t15-,16-/m1/s1
InChIKey RPHKEFNXJBIXPV-SKYCBFMCSA-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 J1UM30kxGPq
Name (3S,4R)-4-Ethoxycarbonyl-1-methyl-3-phenyl-2(6H)-azoninone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO3
InChI InChI=1S/C18H23NO3/c1-3-22-18(21)15-12-8-5-9-13-19(2)17(20)16(15)14-10-6-4-7-11-14/h4,6-8,10-12,15-16H,3,5,9,13H2,1-2H3/b12-8+/t15-,16-/m1/s1
InChIKey RPHKEFNXJBIXPV-SKYCBFMCSA-N
Molecular Weight 301.386 g/mol
SMILES C1([C@@]([C@](C(=O)OCC)(\C=C\CCCN1C)[H])(c1ccccc1)[H])=O
SPLASH splash10-0ue9-3900000000-19e1e2f2d3f8f841d490
Source of Spectrum QE-2-898-13
Synonyms (3S,4R)-4-Ethoxycarbonyl-1-methyl-3-phenyl-2,3,4,7,8,9-hexahydro-2-azoninone Ethyl (3S,4R)-1-methyl-2-oxo-3-phenyl-2,3,4,7,8,9-hexahydro-1H-azonine-4-carboxylate
Wiley ID 842622