| SpectraBase Compound ID | JJBHNPStu2A |
|---|---|
| InChI | InChI=1S/C14H11ClS/c15-13-8-6-12(7-9-13)10-11-16-14-4-2-1-3-5-14/h1-11H/b11-10+ |
| InChIKey | LYORDQHVEBYVMV-ZHACJKMWSA-N |
| Mol Weight | 246.75 g/mol |
| Molecular Formula | C14H11ClS |
| Exact Mass | 246.026999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GMReUVtHCgl |
|---|---|
| Name | (4-Chlorostyryl)(phenyl)sulfane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.026999228 u |
| Formula | C14H11ClS |
| InChI | InChI=1S/C14H11ClS/c15-13-8-6-12(7-9-13)10-11-16-14-4-2-1-3-5-14/h1-11H/b11-10+ |
| InChIKey | LYORDQHVEBYVMV-ZHACJKMWSA-N |
| Molecular Weight | 246.755 g/mol |
| SMILES | C1(\C=C\SC2=CC=CC=C2)=CC=C(C=C1)Cl |