| SpectraBase Spectrum ID |
7oHNiu5KFxq |
| Name |
(4R*,5S*)-4,5-Dimethyl-1-(toluene-4-sulfonyl)-1,2,3,4,5,6-hexahydro-[1]-pyrindine-7-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21NO3S |
| InChI |
InChI=1S/C17H21NO3S/c1-11-4-6-14(7-5-11)22(20,21)18-9-8-12(2)16-13(3)10-15(19)17(16)18/h4-7,12-13H,8-10H2,1-3H3/t12-,13+/m1/s1 |
| InChIKey |
CHGUIBZADRINQE-OLZOCXBDSA-N |
| Molecular Weight |
319.419 g/mol |
| SMILES |
c1(S(N2C3=C([C@@](C)(CC3=O)[H])[C@@](CC2)(C)[H])(=O)=O)ccc(cc1)C |
| SPLASH |
splash10-0006-9005000000-1821f53443a5fd82900d |
| Source of Spectrum |
F-68-9740-67 |
| Synonyms |
(4R,5S)-4,5-dimethyl-1-(p-tolylsulfonyl)-3,4,5,6-tetrahydro-2H-cyclopenta[b]pyridin-7-one
(4R,5S)-4,5-dimethyl-1-(4-methylphenyl)sulfonyl-3,4,5,6-tetrahydro-2H-cyclopenta[b]pyridin-7-one |
| Wiley ID |
1573984 |
![(4R*,5S*)-4,5-Dimethyl-1-(toluene-4-sulfonyl)-1,2,3,4,5,6-hexahydro-[1]-pyrindine-7-one](/api/spectrum/7oHNiu5KFxq/structure.png?h=300&w=458 "(4R*,5S*)-4,5-Dimethyl-1-(toluene-4-sulfonyl)-1,2,3,4,5,6-hexahydro-[1]-pyrindine-7-one")
