![2-[(4-Chloro-3,5-xylyl)oxy]ethanol](/api/spectrum/E3xJnlCUH0Q/structure.png?h=300&w=458 "2-[(4-Chloro-3,5-xylyl)oxy]ethanol")
| SpectraBase Compound ID | 45tUt7dXxgt |
|---|---|
| InChI | InChI=1S/C10H13ClO2/c1-7-5-9(13-4-3-12)6-8(2)10(7)11/h5-6,12H,3-4H2,1-2H3 |
| InChIKey | UZXFXOSXXYLVMI-UHFFFAOYSA-N |
| Mol Weight | 200.66 g/mol |
| Molecular Formula | C10H13ClO2 |
| Exact Mass | 200.060407 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | E3xJnlCUH0Q |
|---|---|
| Name | 2-[(4-Chloro-3,5-xylyl)oxy]ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.060407357 u |
| Formula | C10H13ClO2 |
| InChI | InChI=1S/C10H13ClO2/c1-7-5-9(13-4-3-12)6-8(2)10(7)11/h5-6,12H,3-4H2,1-2H3 |
| InChIKey | UZXFXOSXXYLVMI-UHFFFAOYSA-N |
| Molecular Weight | 200.665 g/mol |
| SMILES | OCCOC1=CC(=C(C(=C1)C)Cl)C |
| Spectrum/Structure Validation Score (Raman) | 0.96627 |