| SpectraBase Compound ID | LTIF2CXyZo5 |
|---|---|
| InChI | InChI=1S/C7H11Cl/c8-6-7-4-2-1-3-5-7/h1-2,7H,3-6H2 |
| InChIKey | SFBHUBQGECWONK-UHFFFAOYSA-N |
| Mol Weight | 130.62 g/mol |
| Molecular Formula | C7H11Cl |
| Exact Mass | 130.054928 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9Rial2tFvJv |
|---|---|
| Name | 4-(Chloromethyl)cyclohexene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.054928054 u |
| Formula | C7H11Cl |
| InChI | InChI=1S/C7H11Cl/c8-6-7-4-2-1-3-5-7/h1-2,7H,3-6H2 |
| InChIKey | SFBHUBQGECWONK-UHFFFAOYSA-N |
| Molecular Weight | 130.618 g/mol |
| SMILES | C=1CCC(CC1)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.978241 |