| SpectraBase Compound ID | GypbTXSsbbJ |
|---|---|
| InChI | InChI=1S/C9H9ClO4/c1-13-6-2-3-8(7(10)4-6)14-5-9(11)12/h2-4H,5H2,1H3,(H,11,12) |
| InChIKey | SUOGNJQDYBMKOX-UHFFFAOYSA-N |
| Mol Weight | 216.62 g/mol |
| Molecular Formula | C9H9ClO4 |
| Exact Mass | 216.018936 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Furg8f4AMOg |
|---|---|
| Name | (2-Chloro-4-methoxyphenoxy)acetic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.018936466 u |
| Formula | C9H9ClO4 |
| InChI | InChI=1S/C9H9ClO4/c1-13-6-2-3-8(7(10)4-6)14-5-9(11)12/h2-4H,5H2,1H3,(H,11,12) |
| InChIKey | SUOGNJQDYBMKOX-UHFFFAOYSA-N |
| Molecular Weight | 216.620 g/mol |
| SMILES | OC(COC1=C(C=C(C=C1)OC)Cl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.797195 |