| SpectraBase Spectrum ID |
6SnFIHMCNTk |
| Name |
(3aR,5R)-5-chloro-9-(trifluoromethyl)-2,3,3a,4,5,6-hexahydro-1H-benzo[f]pyrrolo[1,2-a]azepin-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H13ClF3NO |
| InChI |
InChI=1S/C14H13ClF3NO/c15-10-5-8-1-2-9(14(16,17)18)6-12(8)19-11(7-10)3-4-13(19)20/h1-2,6,10-11H,3-5,7H2/t10-,11-/m1/s1 |
| InChIKey |
TUOSAQGCXJJDFE-GHMZBOCLSA-N |
| Literature Reference DOI |
10.1021/ol100220c |
| Molecular Weight |
303.712 g/mol |
| SMILES |
c1cc2c(cc1C(F)(F)F)N1C(CC[C@]1([H])C[C@](Cl)(C2)[H])=O |
| SPLASH |
splash10-0gba-0194000000-62e7cdbd7cc955932930 |
| Source of Spectrum |
A1-12-1696/SM17-4k |
| Wiley ID |
1751988 |
![(3aR,5R)-5-chloro-9-(trifluoromethyl)-2,3,3a,4,5,6-hexahydro-1H-benzo[f]pyrrolo[1,2-a]azepin-1-one](/api/spectrum/6SnFIHMCNTk/structure.png?h=300&w=458 "(3aR,5R)-5-chloro-9-(trifluoromethyl)-2,3,3a,4,5,6-hexahydro-1H-benzo[f]pyrrolo[1,2-a]azepin-1-one")
