| SpectraBase Spectrum ID |
GnHQroesGwZ |
| Name |
2'-Chloro-2-{[2-(dimethylamino)ethyl]thio}acetanilide, monohydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.051689781 u |
| Formula |
C12H18Cl2N2OS |
| InChI |
InChI=1S/C12H17ClN2OS.ClH/c1-15(2)7-8-17-9-12(16)14-11-6-4-3-5-10(11)13;/h3-6H,7-9H2,1-2H3,(H,14,16);1H |
| InChIKey |
RYDMPPQRLCHWJA-UHFFFAOYSA-N |
| Molecular Weight |
309.255 g/mol |
| SMILES |
Cl.N(C1=CC=CC=C1Cl)C(CSCCN(C)C)=O |
| Spectrum/Structure Validation Score (Raman) |
0.827513 |
![2'-Chloro-2-{[2-(dimethylamino)ethyl]thio}acetanilide, monohydrochloride](/api/spectrum/GnHQroesGwZ/structure.png?h=300&w=458 "2'-Chloro-2-{[2-(dimethylamino)ethyl]thio}acetanilide, monohydrochloride")
