| SpectraBase Compound ID | 1f7ojyMjKNZ |
|---|---|
| InChI | InChI=1S/C13H11ClO/c14-10-11-6-4-5-9-13(11)15-12-7-2-1-3-8-12/h1-9H,10H2 |
| InChIKey | VIGILLBRWRDXDA-UHFFFAOYSA-N |
| Mol Weight | 218.68 g/mol |
| Molecular Formula | C13H11ClO |
| Exact Mass | 218.049843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LKpPELC5F2a |
|---|---|
| Name | 1-(Chloromethyl)-2-phenoxybenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.049842673 u |
| Formula | C13H11ClO |
| InChI | InChI=1S/C13H11ClO/c14-10-11-6-4-5-9-13(11)15-12-7-2-1-3-8-12/h1-9H,10H2 |
| InChIKey | VIGILLBRWRDXDA-UHFFFAOYSA-N |
| Molecular Weight | 218.683 g/mol |
| SMILES | C1(OC2=CC=CC=C2)=C(CCl)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94934 |