![Benzene, 1,1'-[thiobis(methylene)]bis[4-chloro-](/api/spectrum/Eyb4OI2r2x2/structure.png?h=300&w=458 "Benzene, 1,1'-[thiobis(methylene)]bis[4-chloro-")
| SpectraBase Compound ID | JrDTpXgW63A |
|---|---|
| InChI | InChI=1S/C14H12Cl2S/c15-13-5-1-11(2-6-13)9-17-10-12-3-7-14(16)8-4-12/h1-8H,9-10H2 |
| InChIKey | ITVKOVQVBCQQGY-UHFFFAOYSA-N |
| Mol Weight | 283.22 g/mol |
| Molecular Formula | C14H12Cl2S |
| Exact Mass | 282.003677 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Eyb4OI2r2x2 |
|---|---|
| Name | Benzene, 1,1'-[thiobis(methylene)]bis[4-chloro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.003676960 u |
| Formula | C14H12Cl2S |
| InChI | InChI=1S/C14H12Cl2S/c15-13-5-1-11(2-6-13)9-17-10-12-3-7-14(16)8-4-12/h1-8H,9-10H2 |
| InChIKey | ITVKOVQVBCQQGY-UHFFFAOYSA-N |
| SMILES | C1(CSCC2=CC=C(Cl)C=C2)=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943862 |