| SpectraBase Compound ID | J6vJ6mKsB6P |
|---|---|
| InChI | InChI=1S/C14H13ClO/c1-16-14-8-7-12(9-13(14)10-15)11-5-3-2-4-6-11/h2-9H,10H2,1H3 |
| InChIKey | HDXGBBJWLGPFQC-UHFFFAOYSA-N |
| Mol Weight | 232.71 g/mol |
| Molecular Formula | C14H13ClO |
| Exact Mass | 232.065493 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 44XmuBRWQx |
|---|---|
| Name | 2-(Chloromethyl)-4-phenylanisole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.065492738 u |
| Formula | C14H13ClO |
| InChI | InChI=1S/C14H13ClO/c1-16-14-8-7-12(9-13(14)10-15)11-5-3-2-4-6-11/h2-9H,10H2,1H3 |
| InChIKey | HDXGBBJWLGPFQC-UHFFFAOYSA-N |
| Molecular Weight | 232.710 g/mol |
| SMILES | C1(=CC(C=2C=CC=CC2)=CC=C1OC)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.925451 |