| SpectraBase Compound ID | 5ek5cnrIofb |
|---|---|
| InChI | InChI=1S/C5H8ClNO/c1-5(6)3-7(2)4-8/h4H,1,3H2,2H3 |
| InChIKey | IWMJCAURDCXHHA-UHFFFAOYSA-N |
| Mol Weight | 133.58 g/mol |
| Molecular Formula | C5H8ClNO |
| Exact Mass | 133.029442 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 76uh0loc4dS |
|---|---|
| Name | N-(2-Chloroallyl)-N-methylformamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 133.029441581 u |
| Formula | C5H8ClNO |
| InChI | InChI=1S/C5H8ClNO/c1-5(6)3-7(2)4-8/h4H,1,3H2,2H3 |
| InChIKey | IWMJCAURDCXHHA-UHFFFAOYSA-N |
| Molecular Weight | 133.578 g/mol |
| SMILES | C(=O)N(CC(=C)Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942515 |