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8-endo-8-Ethoxy-2,4-diphenyl-2,5-diazabicyclo[2.2.2]octane-3,6-dione isomer
SpectraBase Compound ID E9jhRvnziYD
InChI InChI=1S/C20H20N2O3/c1-2-25-17-13-16-18(23)21-20(17,14-9-5-3-6-10-14)19(24)22(16)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3,(H,21,23)/t16-,17+,20-/m0/s1
InChIKey IBQNJFUZDFEHSG-QKLQHJQFSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xtWKMr2wq
Name 8-endo-8-Ethoxy-2,4-diphenyl-2,5-diazabicyclo[2.2.2]octane-3,6-dione isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-2-25-17-13-16-18(23)21-20(17,14-9-5-3-6-10-14)19(24)22(16)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3,(H,21,23)/t16-,17+,20-/m0/s1
InChIKey IBQNJFUZDFEHSG-QKLQHJQFSA-N
Molecular Weight 336.391 g/mol
SMILES N1C([C@]2(N(C([C@@]1([C@@](C2)(OCC)[H])c1ccccc1)=O)c1ccccc1)[H])=O
SPLASH splash10-0il9-0294000000-8ca5bbd371047d4cb6bc
Source of Spectrum KC-57-3217-15
Wiley ID 1623747