| SpectraBase Spectrum ID |
2NBJ5J9EqSS |
| Name |
(3aS,7aS,10aR)-6-methyl-1-[(4-methylphenyl)sulfonyl]-1,4,7,7a,8,9,10,10a-octahydrobenzo[d]indol-3(2H)-one |
| Alternate Name(s) |
6-Methyl-1-tosyl-1,2,3,4,7,7a,8,9,10,10a-decahydro-benzo[d]indol-3-one
(3aR,6aS,10aS)-8-methyl-3-tosyl-2,3,3a,4,5,6,6a,7-octahydrobenzo[d]indol-1(10H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25NO3S |
| InChI |
InChI=1S/C20H25NO3S/c1-14-6-8-17(9-7-14)25(23,24)21-13-19(22)20-11-10-15(2)12-16(20)4-3-5-18(20)21/h6-10,16,18H,3-5,11-13H2,1-2H3/t16-,18+,20-/m0/s1 |
| InChIKey |
CTKPUGSMZLUCGU-HQRMLTQVSA-N |
| Molecular Weight |
359.484 g/mol |
| SMILES |
[C@@]12(N(S(c3ccc(cc3)C)(=O)=O)CC([C@@]11[C@](CC(C)=CC1)(CCC2)[H])=O)[H] |
| SPLASH |
splash10-0002-2900000000-0b2a8df2c8714e61e379 |
| Source of Spectrum |
F5-6-3131-29 |
| Wiley ID |
1733566 |
![(3aS,7aS,10aR)-6-methyl-1-[(4-methylphenyl)sulfonyl]-1,4,7,7a,8,9,10,10a-octahydrobenzo[d]indol-3(2H)-one](/api/spectrum/2NBJ5J9EqSS/structure.png?h=300&w=458 "(3aS,7aS,10aR)-6-methyl-1-[(4-methylphenyl)sulfonyl]-1,4,7,7a,8,9,10,10a-octahydrobenzo[d]indol-3(2H)-one")
