| SpectraBase Compound ID | E3Ovt1cpxEB |
|---|---|
| InChI | InChI=1S/C9H11ClO/c1-11-6-5-8-3-2-4-9(10)7-8/h2-4,7H,5-6H2,1H3 |
| InChIKey | FYAQFSFZEJHDFL-UHFFFAOYSA-N |
| Mol Weight | 170.64 g/mol |
| Molecular Formula | C9H11ClO |
| Exact Mass | 170.049843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6tBVU2mPH9I |
|---|---|
| Name | 3-Chlorophenethyl alcohol, methyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.049842673 u |
| Formula | C9H11ClO |
| InChI | InChI=1S/C9H11ClO/c1-11-6-5-8-3-2-4-9(10)7-8/h2-4,7H,5-6H2,1H3 |
| InChIKey | FYAQFSFZEJHDFL-UHFFFAOYSA-N |
| Molecular Weight | 170.639 g/mol |
| SMILES | C1=C(C=CC=C1CCOC)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.817435 |