| SpectraBase Spectrum ID |
IARaEmIAdJy |
| Name |
AB-005 azepane isomer |
| Alternate Name(s) |
(1-(1-methylazepan-2-yl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
(1-(1-methylazepan-3-yl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32N2O |
| InChI |
InChI=1S/C23H32N2O/c1-22(2)21(23(22,3)4)20(26)18-15-25(19-12-7-6-11-17(18)19)16-10-8-9-13-24(5)14-16/h6-7,11-12,15-16,21H,8-10,13-14H2,1-5H3 |
| InChIKey |
VNSNHIFBQMRMRE-UHFFFAOYSA-N |
| Molecular Weight |
352.522 g/mol |
| SMILES |
c1[n](c2ccccc2c1C(=O)C1C(C1(C)C)(C)C)C1CCCCN(C1)C |
| SPLASH |
splash10-08fr-7911000000-7e431a74df2d2b5eaa01 |
| Source of Spectrum |
SWG-33-3272-0 |
| Wiley ID |
1810133 |
