| SpectraBase Compound ID | 69UM7FEsMKf |
|---|---|
| InChI | InChI=1S/C10H8ClNO3S/c1-15-8(13)5-12-9-6(11)3-2-4-7(9)16-10(12)14/h2-4H,5H2,1H3 |
| InChIKey | ZCDHYAMAXOZQDI-UHFFFAOYSA-N |
| Mol Weight | 257.69 g/mol |
| Molecular Formula | C10H8ClNO3S |
| Exact Mass | 256.991342 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CmiRQ9uhqBH |
|---|---|
| Name | Benazolin me P640 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.991341993 u |
| Formula | C10H8ClNO3S |
| InChI | InChI=1S/C10H8ClNO3S/c1-15-8(13)5-12-9-6(11)3-2-4-7(9)16-10(12)14/h2-4H,5H2,1H3 |
| InChIKey | ZCDHYAMAXOZQDI-UHFFFAOYSA-N |
| SMILES | C=1C=C2SC(N(C2=C(Cl)C1)CC(OC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923691 |