| SpectraBase Compound ID | 6feyCGLiBSY |
|---|---|
| InChI | InChI=1S/C10H13ClO/c1-6(2)8-5-4-7(3)10(12)9(8)11/h4-6,12H,1-3H3 |
| InChIKey | COJGWGSVTCWAGQ-UHFFFAOYSA-N |
| Mol Weight | 184.67 g/mol |
| Molecular Formula | C10H13ClO |
| Exact Mass | 184.065493 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IAwQ9kS1LUi |
|---|---|
| Name | Chlorcarvacrol P356 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.065492738 u |
| Formula | C10H13ClO |
| InChI | InChI=1S/C10H13ClO/c1-6(2)8-5-4-7(3)10(12)9(8)11/h4-6,12H,1-3H3 |
| InChIKey | COJGWGSVTCWAGQ-UHFFFAOYSA-N |
| Molecular Weight | 184.666 g/mol |
| SMILES | C=1C(C)=C(O)C(=C(C(C)C)C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.880451 |