| SpectraBase Compound ID | 7FqU09FeNap |
|---|---|
| InChI | InChI=1S/C9H10O4/c1-12-9(11)6-13-8-4-2-7(10)3-5-8/h2-5,10H,6H2,1H3 |
| InChIKey | OITXOTZGDJLEBU-UHFFFAOYSA-N |
| Mol Weight | 182.17 g/mol |
| Molecular Formula | C9H10O4 |
| Exact Mass | 182.057909 g/mol |
| SpectraBase Spectrum ID | 2uRXjWoOHDy |
|---|---|
| Name | Acetic acid, (4-hydroxyphenoxy)-, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.057908798 u |
| Formula | C9H10O4 |
| InChI | InChI=1S/C9H10O4/c1-12-9(11)6-13-8-4-2-7(10)3-5-8/h2-5,10H,6H2,1H3 |
| InChIKey | OITXOTZGDJLEBU-UHFFFAOYSA-N |
| Molecular Weight | 182.175 g/mol |
| SMILES | C(=O)(COC1=CC=C(C=C1)O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.971754 |