| SpectraBase Spectrum ID |
CbZa6CvZ7aw |
| Name |
4-(4-Chlorophenyl)-7,7-dimethyl-5-oxo-2-(prop-2-yn-1-ylsulfanyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19ClN2OS |
| InChI |
InChI=1S/C21H19ClN2OS/c1-4-9-26-20-15(12-23)18(13-5-7-14(22)8-6-13)19-16(24-20)10-21(2,3)11-17(19)25/h1,5-8,18,24H,9-11H2,2-3H3 |
| InChIKey |
NFVOSUYPJNEEEF-UHFFFAOYSA-N |
| Molecular Weight |
382.909 g/mol |
| SMILES |
N1C2=C(C(C(=C1SCC#C)C#N)c1ccc(cc1)Cl)C(CC(C2)(C)C)=O |
| SPLASH |
splash10-00e9-0096000000-01f4ec8ad7efec5ab6a6 |
| Source of Spectrum |
O1-47-1122-3b |
| Wiley ID |
1690384 |
