| SpectraBase Spectrum ID |
G2B5qxGqeX3 |
| Name |
{4-[4-Chloro-2-(4-chlorophenylsulfanyl)benzenesulfinyl]phenyl} dimethylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.042412381 u |
| Formula |
C20H17ClFNOS2 |
| InChI |
InChI=1S/C20H17ClFNOS2/c1-23(2)16-6-10-18(11-7-16)26(24)20-12-5-15(22)13-19(20)25-17-8-3-14(21)4-9-17/h3-13H,1-2H3 |
| InChIKey |
MICWGWMQKUVCRE-UHFFFAOYSA-N |
| Molecular Weight |
405.933 g/mol |
| SMILES |
C1=C(F)C=CC(S(C2=CC=C(C=C2)N(C)C)=O)=C1SC=1C=CC(Cl)=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903458 |
![{4-[4-Chloro-2-(4-chlorophenylsulfanyl)benzenesulfinyl]phenyl} dimethylamine](/api/spectrum/G2B5qxGqeX3/structure.png?h=300&w=458 "{4-[4-Chloro-2-(4-chlorophenylsulfanyl)benzenesulfinyl]phenyl} dimethylamine")
