| SpectraBase Spectrum ID |
C9iMCTAClFg |
| Name |
2-Chloro-6-fluorobenzyl 4-chlorophenyl sulfide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
285.978605027 u |
| Formula |
C13H9Cl2FS |
| InChI |
InChI=1S/C13H9Cl2FS/c14-9-4-6-10(7-5-9)17-8-11-12(15)2-1-3-13(11)16/h1-7H,8H2 |
| InChIKey |
QHXZUTHJIKFVNM-UHFFFAOYSA-N |
| Molecular Weight |
287.179 g/mol |
| SMILES |
C1(CSC2=CC=C(C=C2)Cl)=C(F)C=CC=C1Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902485 |
