| SpectraBase Spectrum ID |
4eBoeduoFsU |
| Name |
8-exo-Methyl 3,6-dioxo-2-phenyl-2,5-diazabicyclo[2.2.2]octane-7(8)-carboxylate isomer |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14N2O4 |
| InChI |
InChI=1S/C14H14N2O4/c1-20-14(19)9-7-10-12(17)15-11(9)13(18)16(10)8-5-3-2-4-6-8/h2-6,9-11H,7H2,1H3,(H,15,17)/t9?,10-,11-/m1/s1 |
| InChIKey |
PQHWGYMJESRJSZ-FHZGLPGMSA-N |
| Molecular Weight |
274.276 g/mol |
| SMILES |
N1C([C@@]2(N(C([C@]1(C(C2)C(=O)OC)[H])=O)c1ccccc1)[H])=O |
| SPLASH |
splash10-00di-0090000000-bfcdde970c975c73a5bb |
| Source of Spectrum |
KC-57-3217-14 |
| Wiley ID |
1623749 |
![8-exo-Methyl 3,6-dioxo-2-phenyl-2,5-diazabicyclo[2.2.2]octane-7(8)-carboxylate isomer](/api/spectrum/4eBoeduoFsU/structure.png?h=300&w=458 "8-exo-Methyl 3,6-dioxo-2-phenyl-2,5-diazabicyclo[2.2.2]octane-7(8)-carboxylate isomer")
