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Methyl 4-benzyl-1-methyl-2-oxo-8-phenyl-1,2,3,4,5,6-hexahydro-1,4-diazocin-6-carboxylate
SpectraBase Compound ID GekDtEwYttw
InChI InChI=1S/C22H24N2O3/c1-23-20(18-11-7-4-8-12-18)13-19(22(26)27-2)15-24(16-21(23)25)14-17-9-5-3-6-10-17/h3-13,19H,14-16H2,1-2H3/b20-13-
InChIKey NNUBLLOAHPUINP-MOSHPQCFSA-N
Mol Weight 364.45 g/mol
Molecular Formula C22H24N2O3
Exact Mass 364.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BZbrh2wkPv
Name Methyl 4-benzyl-1-methyl-2-oxo-8-phenyl-1,2,3,4,5,6-hexahydro-1,4-diazocin-6-carboxylate
Alternate Name(s) (5Z)-4-methyl-3-oxo-5-phenyl-1-(phenylmethyl)-7,8-dihydro-2H-1,4-diazocine-7-carboxylic acid methyl ester Methyl (5Z)-1-benzyl-4-methyl-3-oxo-5-phenyl-7,8-dihydro-2H-1,4-diazocine-7-carboxylate Methyl (5Z)-4-methyl-3-oxidanylidene-5-phenyl-1-(phenylmethyl)-7,8-dihydro-2H-1,4-diazocine-7-carboxylate
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Formula C22H24N2O3
InChI InChI=1S/C22H24N2O3/c1-23-20(18-11-7-4-8-12-18)13-19(22(26)27-2)15-24(16-21(23)25)14-17-9-5-3-6-10-17/h3-13,19H,14-16H2,1-2H3/b20-13-
InChIKey NNUBLLOAHPUINP-MOSHPQCFSA-N
Molecular Weight 364.445 g/mol
SMILES C1(N(\C(=C/C(CN(C1)Cc1ccccc1)C(=O)OC)c1ccccc1)C)=O
SPLASH splash10-052f-8597000000-03180e8dbd0e37e9cd83
Source of Spectrum U1-2009-5435-9b
Wiley ID 1697283