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7-endo-Methyl 3,6-dioxo-2,4-diphenyl-2,5-diazabicyclo[2.2.2]octane-7-carboxylate isomer
SpectraBase Compound ID EMaluaP6TaX
InChI InChI=1S/C20H18N2O4/c1-26-18(24)15-12-20(13-8-4-2-5-9-13)19(25)22(16(15)17(23)21-20)14-10-6-3-7-11-14/h2-11,15-16H,12H2,1H3,(H,21,23)/t15?,16-,20+/m0/s1
InChIKey SRCQZTSVKAJRFM-XGNAPRINSA-N
Mol Weight 350.37 g/mol
Molecular Formula C20H18N2O4
Exact Mass 350.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CvDTw3xOQKM
Name 7-endo-Methyl 3,6-dioxo-2,4-diphenyl-2,5-diazabicyclo[2.2.2]octane-7-carboxylate isomer
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Formula C20H18N2O4
InChI InChI=1S/C20H18N2O4/c1-26-18(24)15-12-20(13-8-4-2-5-9-13)19(25)22(16(15)17(23)21-20)14-10-6-3-7-11-14/h2-11,15-16H,12H2,1H3,(H,21,23)/t15?,16-,20+/m0/s1
InChIKey SRCQZTSVKAJRFM-XGNAPRINSA-N
Molecular Weight 350.374 g/mol
SMILES N1C([C@]2(N(C([C@@]1(CC2C(=O)OC)c1ccccc1)=O)c1ccccc1)[H])=O
SPLASH splash10-00b9-0972000000-b268db695856e2ac2be8
Source of Spectrum KC-57-3217-16
Synonyms Methyl 3,6-dioxo-2,4-diphenyl-2,5-diazabicyclo[2.2.2]octane-7-carboxylate
Wiley ID 1623745