| SpectraBase Compound ID | EAlBf3awZa5 |
|---|---|
| InChI | InChI=1S/C12H17ClO/c1-3-4-5-8-14-12-9-10(2)6-7-11(12)13/h6-7,9H,3-5,8H2,1-2H3 |
| InChIKey | ZYXRZGUNFBDUAD-UHFFFAOYSA-N |
| Mol Weight | 212.72 g/mol |
| Molecular Formula | C12H17ClO |
| Exact Mass | 212.096793 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KrYWvOzTarW |
|---|---|
| Name | 2-Chloro-5-methylphenol, N-pentyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.096792866 u |
| Formula | C12H17ClO |
| InChI | InChI=1S/C12H17ClO/c1-3-4-5-8-14-12-9-10(2)6-7-11(12)13/h6-7,9H,3-5,8H2,1-2H3 |
| InChIKey | ZYXRZGUNFBDUAD-UHFFFAOYSA-N |
| Molecular Weight | 212.720 g/mol |
| SMILES | C1(=CC=C(C=C1OCCCCC)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951873 |