| SpectraBase Compound ID | 1AT4mumEeHS |
|---|---|
| InChI | InChI=1S/C10H11ClO/c1-8-3-5-10(6-4-8)12-7-9(2)11/h3-6H,2,7H2,1H3 |
| InChIKey | OMEBITJMTJRJOZ-UHFFFAOYSA-N |
| Mol Weight | 182.65 g/mol |
| Molecular Formula | C10H11ClO |
| Exact Mass | 182.049843 g/mol |
| SpectraBase Spectrum ID | 1eUwmjfD0wB |
|---|---|
| Name | Benzene, 1-[(2-chloro-2-propenyl)oxy]-4-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.049842673 u |
| Formula | C10H11ClO |
| InChI | InChI=1S/C10H11ClO/c1-8-3-5-10(6-4-8)12-7-9(2)11/h3-6H,2,7H2,1H3 |
| InChIKey | OMEBITJMTJRJOZ-UHFFFAOYSA-N |
| Molecular Weight | 182.650 g/mol |
| SMILES | C(=C)(COC=1C=CC(C)=CC1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936399 |