| SpectraBase Spectrum ID |
KvA9Uqn8Cb3 |
| Name |
Benzo[f]quinoline-3-carboxaldehyde, 1,2,3,4,4a,5,6,10b-octahydro-8-methoxy-4-[(4-methylphenyl)sulfonyl]-, [3S-(3.alpha.,4a.alpha.,10b.alpha.)]- |
| Alternate Name(s) |
(3S,4aS,10bR)-8-methoxy-4-[(4-methylphenyl)sulfonyl]-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline-3-carbaldehyde
N-tosyl-3-formyl-1,2,3,4,4a,5,6,10b-octahydro-benzo(f)quinoline |
| CAS Registry Number |
68323-59-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO4S |
| InChI |
InChI=1S/C22H25NO4S/c1-15-3-8-19(9-4-15)28(25,26)23-17(14-24)6-10-21-20-11-7-18(27-2)13-16(20)5-12-22(21)23/h3-4,7-9,11,13-14,17,21-22H,5-6,10,12H2,1-2H3/t17-,21+,22-/m0/s1 |
| InChIKey |
HDCPOENFIHHXAK-WTOYTKOKSA-N |
| Molecular Weight |
399.505 g/mol |
| SMILES |
[C@]12(N(S(c3ccc(cc3)C)(=O)=O)[C@@](CC[C@@]1(c1ccc(cc1CC2)OC)[H])(C=O)[H])[H] |
| SPLASH |
splash10-0006-9000000000-794e99e84e50ef8d3a8c |
| Source of Spectrum |
F-34-1024-0 |
| Wiley ID |
1368966 |
![Benzo[f]quinoline-3-carboxaldehyde, 1,2,3,4,4a,5,6,10b-octahydro-8-methoxy-4-[(4-methylphenyl)sulfonyl]-, [3S-(3.alpha.,4a.alpha.,10b.alpha.)]-](/api/spectrum/KvA9Uqn8Cb3/structure.png?h=300&w=458 "Benzo[f]quinoline-3-carboxaldehyde, 1,2,3,4,4a,5,6,10b-octahydro-8-methoxy-4-[(4-methylphenyl)sulfonyl]-, [3S-(3.alpha.,4a.alpha.,10b.alpha.)]-")
