| SpectraBase Compound ID | Jbat832UaGT |
|---|---|
| InChI | InChI=1S/C9H10ClNS/c1-11(2)9(12)7-3-5-8(10)6-4-7/h3-6H,1-2H3 |
| InChIKey | ANUVRTDELFGTRW-UHFFFAOYSA-N |
| Mol Weight | 199.7 g/mol |
| Molecular Formula | C9H10ClNS |
| Exact Mass | 199.022248 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | En5machqZ1i |
|---|---|
| Name | p-Chloro-N,N-dimethylthiobenzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.022248200 u |
| Formula | C9H10ClNS |
| InChI | InChI=1S/C9H10ClNS/c1-11(2)9(12)7-3-5-8(10)6-4-7/h3-6H,1-2H3 |
| InChIKey | ANUVRTDELFGTRW-UHFFFAOYSA-N |
| Molecular Weight | 199.699 g/mol |
| SMILES | C=1C(=CC=C(C1)Cl)C(N(C)C)=S |
| Spectrum/Structure Validation Score (Raman) | 0.849921 |