| SpectraBase Spectrum ID |
2mNXy467onz |
| Name |
exo-3-(4-Ethylphenyl)-2-(4-tolylsulfonyl)-2-azabicyclo[2.2.2]octan-5-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO3S |
| InChI |
InChI=1S/C22H25NO3S/c1-3-16-6-8-17(9-7-16)22-20-13-10-18(14-21(20)24)23(22)27(25,26)19-11-4-15(2)5-12-19/h4-9,11-12,18,20,22H,3,10,13-14H2,1-2H3/t18-,20+,22-/m0/s1 |
| InChIKey |
FGWCZRHYLUHWPD-UHFFFAOYSA-N |
| Molecular Weight |
383.506 g/mol |
| SMILES |
[C@@]1(N(S(c2ccc(cc2)C)(=O)=O)[C@]2(CC[C@@]1(C(C2)=O)[H])[H])(c1ccc(cc1)CC)[H] |
| SPLASH |
splash10-004i-0090000000-4c54d734e3d545cc19cd |
| Source of Spectrum |
U1-2002-3675-5 |
| Synonyms |
endo-3-(4-Ethylphenyl)-2-(4-tolylsulfonyl)-2-azabicyclo[2.2.2]octan-5-one
3-(4-ethylphenyl)-2-[(4-methylphenyl)sulfonyl]-2-azabicyclo[2.2.2]octan-5-one |
| Wiley ID |
1523414 |
![exo-3-(4-Ethylphenyl)-2-(4-tolylsulfonyl)-2-azabicyclo[2.2.2]octan-5-one](/api/spectrum/2mNXy467onz/structure.png?h=300&w=458 "exo-3-(4-Ethylphenyl)-2-(4-tolylsulfonyl)-2-azabicyclo[2.2.2]octan-5-one")
