| SpectraBase Compound ID | LEHW6EqamRs |
|---|---|
| InChI | InChI=1S/C10H11ClO/c1-10(6-11)7-12-9-5-3-2-4-8(9)10/h2-5H,6-7H2,1H3 |
| InChIKey | MYUBVWCGXGWKKD-UHFFFAOYSA-N |
| Mol Weight | 182.65 g/mol |
| Molecular Formula | C10H11ClO |
| Exact Mass | 182.049843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JPcGXy67f9m |
|---|---|
| Name | Benzofuran, 3-(chloromethyl)-2,3-dihydro-3-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/c1-10(6-11)7-12-9-5-3-2-4-8(9)10/h2-5H,6-7H2,1H3 |
| InChIKey | MYUBVWCGXGWKKD-UHFFFAOYSA-N |
| Molecular Weight | 182.650 g/mol |
| SMILES | C1(C=2C(=CC=CC2)OC1)(CCl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.979726 |