| SpectraBase Compound ID | Jy6arVpFLVW |
|---|---|
| InChI | InChI=1S/C2HBrClN/c3-2(4)1-5/h2H |
| InChIKey | BMWPPNAUMLRKML-UHFFFAOYSA-N |
| Mol Weight | 154.39 g/mol |
| Molecular Formula | C2HBrClN |
| Exact Mass | 152.89809 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CWI97Zfd1K1 |
|---|---|
| Name | Acetonitrile, bromochloro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.898089736 u |
| Formula | C2HBrClN |
| InChI | InChI=1S/C2HBrClN/c3-2(4)1-5/h2H |
| InChIKey | BMWPPNAUMLRKML-UHFFFAOYSA-N |
| SMILES | C(Cl)(Br)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.817081 |