| SpectraBase Compound ID | 4talpkJKTV0 |
|---|---|
| InChI | InChI=1S/C7H13Cl/c1-6(8)5-7(2,3)4/h1,5H2,2-4H3 |
| InChIKey | KBXPVLVDPCPFTI-UHFFFAOYSA-N |
| Mol Weight | 132.63 g/mol |
| Molecular Formula | C7H13Cl |
| Exact Mass | 132.070578 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GM7EoZcpylO |
|---|---|
| Name | 2-Chloro-4,4-dimethyl-1-pentene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 132.070578119 u |
| Formula | C7H13Cl |
| InChI | InChI=1S/C7H13Cl/c1-6(8)5-7(2,3)4/h1,5H2,2-4H3 |
| InChIKey | KBXPVLVDPCPFTI-UHFFFAOYSA-N |
| SMILES | C=C(CC(C)(C)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.896492 |