| SpectraBase Compound ID | DYOWalbzvyr |
|---|---|
| InChI | InChI=1S/C10H9NO4/c1-14-8-4-2-3-7(5-11)10(8)15-6-9(12)13/h2-4H,6H2,1H3,(H,12,13) |
| InChIKey | WSXLKIGRQBXNKN-UHFFFAOYSA-N |
| Mol Weight | 207.18 g/mol |
| Molecular Formula | C10H9NO4 |
| Exact Mass | 207.053158 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7Mlcl3BDn6Y |
|---|---|
| Name | (2-Cyano-6-methoxyphenoxy)acetic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.053157770 u |
| Formula | C10H9NO4 |
| InChI | InChI=1S/C10H9NO4/c1-14-8-4-2-3-7(5-11)10(8)15-6-9(12)13/h2-4H,6H2,1H3,(H,12,13) |
| InChIKey | WSXLKIGRQBXNKN-UHFFFAOYSA-N |
| Molecular Weight | 207.185 g/mol |
| SMILES | OC(COC1=C(C=CC=C1C#N)OC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.953614 |