| SpectraBase Compound ID | 3b3ZQmRxkAK |
|---|---|
| InChI | InChI=1S/C7H11ClO/c1-5-6(8)3-2-4-7(5)9/h7,9H,2-4H2,1H3 |
| InChIKey | RNJYVOCTEHJXME-UHFFFAOYSA-N |
| Mol Weight | 146.62 g/mol |
| Molecular Formula | C7H11ClO |
| Exact Mass | 146.049843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3IQN0W8NukX |
|---|---|
| Name | 3-Chloranyl-2-methyl-cyclohex-2-en-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.049842673 u |
| Formula | C7H11ClO |
| InChI | InChI=1S/C7H11ClO/c1-5-6(8)3-2-4-7(5)9/h7,9H,2-4H2,1H3 |
| InChIKey | RNJYVOCTEHJXME-UHFFFAOYSA-N |
| SMILES | C1(=C(Cl)CCCC1O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935855 |