| SpectraBase Compound ID | 61CQNIE445a |
|---|---|
| InChI | InChI=1S/C8H9ClO2/c1-10-6-11-8-5-3-2-4-7(8)9/h2-5H,6H2,1H3 |
| InChIKey | SMJFIELODILNDM-UHFFFAOYSA-N |
| Mol Weight | 172.61 g/mol |
| Molecular Formula | C8H9ClO2 |
| Exact Mass | 172.029107 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7Favzb3OwJ6 |
|---|---|
| Name | Benzene, 1-chloro-2-(methoxymethoxy)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.029107228 u |
| Formula | C8H9ClO2 |
| InChI | InChI=1S/C8H9ClO2/c1-10-6-11-8-5-3-2-4-7(8)9/h2-5H,6H2,1H3 |
| InChIKey | SMJFIELODILNDM-UHFFFAOYSA-N |
| Molecular Weight | 172.611 g/mol |
| SMILES | C1=C(Cl)C(OCOC)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.900331 |