For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7-endo-7-Ethoxy-2,4-diphenyl-2,5-diazabicyclo[2.2.2]octane-3,6-dione isomer
SpectraBase Compound ID h36UUu50lY
InChI InChI=1S/C20H20N2O3/c1-2-25-16-13-20(14-9-5-3-6-10-14)19(24)22(17(16)18(23)21-20)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3,(H,21,23)/t16?,17-,20+/m0/s1
InChIKey PQEFOZDBPQHBIN-KKOVZHJLSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4a00Ktgbpvb
Name 7-endo-7-Ethoxy-2,4-diphenyl-2,5-diazabicyclo[2.2.2]octane-3,6-dione isomer
Alternate Name(s) 7-exo-7-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/c1-2-25-16-13-20(14-9-5-3-6-10-14)19(24)22(17(16)18(23)21-20)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3,(H,21,23)/t16?,17-,20+/m0/s1
InChIKey PQEFOZDBPQHBIN-KKOVZHJLSA-N
Molecular Weight 336.391 g/mol
SMILES N1C([C@]2(N(C([C@@]1(CC2OCC)c1ccccc1)=O)c1ccccc1)[H])=O
SPLASH splash10-0459-0591000000-2c29fb37d82deff858a1
Source of Spectrum KC-57-3217-15
Wiley ID 1623748