| SpectraBase Spectrum ID |
98L82LZrUAT |
| Name |
Piperidine, 1-[2-(4-chlorophenyl)-3-(dimethylamino)-1-thioxo-2-propenyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.111397558 u |
| Formula |
C16H21ClN2S |
| InChI |
InChI=1S/C16H21ClN2S/c1-18(2)12-15(13-6-8-14(17)9-7-13)16(20)19-10-4-3-5-11-19/h6-9,12H,3-5,10-11H2,1-2H3/b15-12+ |
| InChIKey |
FQKANHPPEDCJIP-NTCAYCPXSA-N |
| Molecular Weight |
308.871 g/mol |
| SMILES |
CN(C)\C=C\(C(=S)N1CCCCC1)C1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914333 |
![Piperidine, 1-[2-(4-chlorophenyl)-3-(dimethylamino)-1-thioxo-2-propenyl]-](/api/spectrum/98L82LZrUAT/structure.png?h=300&w=458 "Piperidine, 1-[2-(4-chlorophenyl)-3-(dimethylamino)-1-thioxo-2-propenyl]-")
