| SpectraBase Compound ID | ADjRFwXNezo |
|---|---|
| InChI | InChI=1S/C7H14ClN/c1-5(2)9-7(4)6(3)8/h5-6H,1-4H3/b9-7+ |
| InChIKey | ORRYNFSJIDDJAA-VQHVLOKHSA-N |
| Mol Weight | 147.65 g/mol |
| Molecular Formula | C7H14ClN |
| Exact Mass | 147.081477 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IYiZHslN45M |
|---|---|
| Name | N-iso-Propyl-3-chloro-2-butanimine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.081477155 u |
| Formula | C7H14ClN |
| InChI | InChI=1S/C7H14ClN/c1-5(2)9-7(4)6(3)8/h5-6H,1-4H3/b9-7+ |
| InChIKey | ORRYNFSJIDDJAA-VQHVLOKHSA-N |
| Molecular Weight | 147.649 g/mol |
| SMILES | C(\C(=N\C(C)C)C)(Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963433 |