| SpectraBase Spectrum ID |
ASyxLSEhcJm |
| Name |
6H-1-(4-Chlorophenyl)-2,7,7-trimethyl-4,5,7,8-tetrahydropyrrolo[3,2-c]azepin-4-thione |
| Alternate Name(s) |
1-(4-chlorophenyl)-2,7,7-trimethyl-5,6,7,8-tetrahydropyrrolo[3,2-c]azepine-4(1H)-thione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19ClN2S |
| InChI |
InChI=1S/C17H19ClN2S/c1-11-8-14-15(9-17(2,3)10-19-16(14)21)20(11)13-6-4-12(18)5-7-13/h4-8H,9-10H2,1-3H3,(H,19,21) |
| InChIKey |
MZOSOXNTGBYZHG-UHFFFAOYSA-N |
| Molecular Weight |
318.866 g/mol |
| SMILES |
N1CC(Cc2c(C1=S)cc([n]2-c1ccc(cc1)Cl)C)(C)C |
| SPLASH |
splash10-0gb9-0009000000-b9b23c55868d691ff621 |
| Source of Spectrum |
H1-53-565-4 |
| Wiley ID |
817852 |
![6H-1-(4-Chlorophenyl)-2,7,7-trimethyl-4,5,7,8-tetrahydropyrrolo[3,2-c]azepin-4-thione](/api/spectrum/ASyxLSEhcJm/structure.png?h=300&w=458 "6H-1-(4-Chlorophenyl)-2,7,7-trimethyl-4,5,7,8-tetrahydropyrrolo[3,2-c]azepin-4-thione")
