| SpectraBase Compound ID | 5RWonXDpasb |
|---|---|
| InChI | InChI=1S/C9H10O3/c1-11-9(10)7-12-8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
| InChIKey | BZCKRPHEZOHHBK-UHFFFAOYSA-N |
| Mol Weight | 166.18 g/mol |
| Molecular Formula | C9H10O3 |
| Exact Mass | 166.062994 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 32xtjy7SE1k |
|---|---|
| Name | Phenoxyacetic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.062994179 u |
| Formula | C9H10O3 |
| InChI | InChI=1S/C9H10O3/c1-11-9(10)7-12-8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
| InChIKey | BZCKRPHEZOHHBK-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=CC1)OCC(OC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.753978 |