| SpectraBase Compound ID | 9ns76mpHIqs |
|---|---|
| InChI | InChI=1S/C2Cl2FN/c3-2(4,5)1-6 |
| InChIKey | IUHXUTRMGQCBPC-UHFFFAOYSA-N |
| Mol Weight | 127.93 g/mol |
| Molecular Formula | C2Cl2FN |
| Exact Mass | 126.939183 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ItcWXs58rLg |
|---|---|
| Name | Acetonitrile, dichlorofluoro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 126.939182567 u |
| Formula | C2Cl2FN |
| InChI | InChI=1S/C2Cl2FN/c3-2(4,5)1-6 |
| InChIKey | IUHXUTRMGQCBPC-UHFFFAOYSA-N |
| Molecular Weight | 127.933 g/mol |
| SMILES | C(Cl)(Cl)(F)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.837845 |