| SpectraBase Compound ID | CswlKc7HuoT |
|---|---|
| InChI | InChI=1S/C7H5ClN2/c8-6-2-1-3-7(4-6)10-5-9/h1-4,10H |
| InChIKey | DCMFSSNEAKEHAM-UHFFFAOYSA-N |
| Mol Weight | 152.58 g/mol |
| Molecular Formula | C7H5ClN2 |
| Exact Mass | 152.014126 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1gbLcbnJr6H |
|---|---|
| Name | N-(3-Chlorophenyl)cyanamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.014125869 u |
| Formula | C7H5ClN2 |
| InChI | InChI=1S/C7H5ClN2/c8-6-2-1-3-7(4-6)10-5-9/h1-4,10H |
| InChIKey | DCMFSSNEAKEHAM-UHFFFAOYSA-N |
| Molecular Weight | 152.584 g/mol |
| SMILES | C=1(Cl)C=CC=C(NC#N)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.928005 |